USER MOD reduce.3.24.130724 H: found=0, std=0, add=1029, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1029 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 155 LYS NZ :NH3+ 137:sc= 0.949 (180deg=0) USER MOD Set 1.2: A 157 ASN : amide:sc= 0.587 K(o=1.5,f=-2.6) USER MOD Set 2.1: A 131 HIS : no HD1:sc= -2.75! C(o=-4.6!,f=-8!) USER MOD Set 2.2: A 142 CYS SG : rot 129:sc= -0.512 USER MOD Set 2.3: A 143 CYS SG : rot -96:sc= -0.761 USER MOD Set 2.4: A 145 GLN :FLIP amide:sc= 0 F(o=-5.3,f=-4.6) USER MOD Set 2.5: A 153 CYS SG : rot -61:sc= -0.55 USER MOD Set 3.1: A 136 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 139 SER OG : rot 105:sc= 0.00407 USER MOD Set 4.1: A 105 SER OG : rot -160:sc= -0.191 USER MOD Set 4.2: A 108 SER OG : rot 180:sc= 0.00576 USER MOD Set 5.1: A 94 HIS : +bothHN:sc= -0.737 K(o=-0.91,f=-2.8) USER MOD Set 5.2: A 97 ASN : amide:sc= -0.169 K(o=-0.91,f=-4.2!) USER MOD Set 6.1: A 70 LYS NZ :NH3+ -178:sc= 0.53 (180deg=-0.112) USER MOD Set 6.2: A 125 ASN : amide:sc=-0.00317 K(o=0.53,f=-7.7!) USER MOD Set 7.1: A 47 MET CE :methyl -165:sc= -0.108 (180deg=-0.456) USER MOD Set 7.2: A 49 THR OG1 : rot -170:sc= 0 USER MOD Single : A 15 THR OG1 : rot 31:sc= 1.03 USER MOD Single : A 23 LYS NZ :NH3+ 179:sc= 0 (180deg=-3.24e-05) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -1.05 K(o=-1,f=-4.7!) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot -19:sc= 1.07 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 CYS SG : rot 66:sc= 0.913 USER MOD Single : A 76 LYS NZ :NH3+ 165:sc= 0.667 (180deg=0.512) USER MOD Single : A 84 CYS SG : rot -170:sc= -2.45 USER MOD Single : A 85 GLN : amide:sc= -0.589 X(o=-0.59,f=-0.61) USER MOD Single : A 86 ASN : amide:sc= -0.234 K(o=-0.23,f=-5.2!) USER MOD Single : A 87 LYS NZ :NH3+ 153:sc= 0.477 (180deg=0.161) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= -0.253 K(o=-0.25,f=-4.3!) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot -21:sc= 1.74 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ -119:sc= 0.0651 (180deg=-1.5!) USER MOD Single : A 121 LYS NZ :NH3+ -128:sc= 0.679 (180deg=-0.365) USER MOD Single : A 122 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 123 ASN :FLIP amide:sc= -1.88 F(o=-3.8!,f=-1.9) USER MOD Single : A 124 ASN :FLIP amide:sc= -0.0116 F(o=-1.7!,f=-0.012) USER MOD Single : A 127 MET CE :methyl -173:sc= -0.565 (180deg=-0.9) USER MOD Single : A 129 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00415) USER MOD Single : A 130 TYR OH : rot -108:sc= 0.258 USER MOD Single : A 133 LYS NZ :NH3+ 169:sc= 1.24 (180deg=1.15) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN : amide:sc= -4.92! C(o=-4.9!,f=-7.7!) USER MOD Single : A 146 THR OG1 : rot -79:sc= 0.0849 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 TYR OH : rot 34:sc= -0.101 USER MOD ----------------------------------------------------------------- ATOM 229 N THR A 15 -9.724 -1.735 14.740 1.00 25.53 N ATOM 230 CA THR A 15 -9.185 -1.595 13.392 1.00 24.53 C ATOM 231 C THR A 15 -9.967 -0.533 12.599 1.00 34.33 C ATOM 232 O THR A 15 -11.202 -0.460 12.670 1.00 61.22 O ATOM 233 CB THR A 15 -9.177 -2.967 12.630 1.00 34.41 C ATOM 234 OG1 THR A 15 -8.661 -2.811 11.296 1.00 15.40 O ATOM 235 CG2 THR A 15 -10.573 -3.613 12.566 1.00 23.24 C ATOM 0 HA THR A 15 -8.151 -1.263 13.483 1.00 24.53 H new ATOM 0 HB THR A 15 -8.525 -3.630 13.199 1.00 34.41 H new ATOM 0 HG1 THR A 15 -8.007 -2.082 11.282 1.00 15.40 H new ATOM 0 HG21 THR A 15 -10.512 -4.559 12.029 1.00 23.24 H new ATOM 0 HG22 THR A 15 -10.937 -3.793 13.577 1.00 23.24 H new ATOM 0 HG23 THR A 15 -11.260 -2.945 12.047 1.00 23.24 H new ATOM 243 N ILE A 16 -9.211 0.315 11.907 1.00 1.32 N ATOM 244 CA ILE A 16 -9.726 1.334 10.989 1.00 61.13 C ATOM 245 C ILE A 16 -10.431 0.662 9.799 1.00 52.30 C ATOM 246 O ILE A 16 -11.465 1.143 9.323 1.00 65.52 O ATOM 247 CB ILE A 16 -8.547 2.247 10.488 1.00 31.23 C ATOM 248 CG1 ILE A 16 -7.756 2.825 11.708 1.00 52.00 C ATOM 249 CG2 ILE A 16 -9.056 3.382 9.560 1.00 63.31 C ATOM 250 CD1 ILE A 16 -6.518 3.617 11.345 1.00 25.14 C ATOM 0 H ILE A 16 -8.193 0.314 11.969 1.00 1.32 H new ATOM 0 HA ILE A 16 -10.450 1.957 11.514 1.00 61.13 H new ATOM 0 HB ILE A 16 -7.870 1.631 9.896 1.00 31.23 H new ATOM 0 HG12 ILE A 16 -8.423 3.465 12.285 1.00 52.00 H new ATOM 0 HG13 ILE A 16 -7.465 2.000 12.358 1.00 52.00 H new ATOM 0 HG21 ILE A 16 -8.213 3.991 9.234 1.00 63.31 H new ATOM 0 HG22 ILE A 16 -9.547 2.947 8.689 1.00 63.31 H new ATOM 0 HG23 ILE A 16 -9.766 4.006 10.104 1.00 63.31 H new ATOM 0 HD11 ILE A 16 -6.037 3.977 12.254 1.00 25.14 H new ATOM 0 HD12 ILE A 16 -5.826 2.979 10.796 1.00 25.14 H new ATOM 0 HD13 ILE A 16 -6.799 4.467 10.723 1.00 25.14 H new ATOM 262 N LEU A 17 -9.869 -0.480 9.363 1.00 23.03 N ATOM 263 CA LEU A 17 -10.395 -1.247 8.230 1.00 53.13 C ATOM 264 C LEU A 17 -9.708 -2.620 8.163 1.00 14.21 C ATOM 265 O LEU A 17 -8.496 -2.717 8.374 1.00 0.00 O ATOM 266 CB LEU A 17 -10.179 -0.464 6.900 1.00 4.32 C ATOM 267 CG LEU A 17 -10.842 -1.060 5.624 1.00 61.54 C ATOM 268 CD1 LEU A 17 -12.367 -1.233 5.809 1.00 62.15 C ATOM 269 CD2 LEU A 17 -10.514 -0.183 4.397 1.00 71.04 C ATOM 0 H LEU A 17 -9.039 -0.893 9.789 1.00 23.03 H new ATOM 0 HA LEU A 17 -11.465 -1.397 8.371 1.00 53.13 H new ATOM 0 HB2 LEU A 17 -10.555 0.550 7.037 1.00 4.32 H new ATOM 0 HB3 LEU A 17 -9.107 -0.385 6.721 1.00 4.32 H new ATOM 0 HG LEU A 17 -10.430 -2.054 5.453 1.00 61.54 H new ATOM 0 HD11 LEU A 17 -12.799 -1.651 4.900 1.00 62.15 H new ATOM 0 HD12 LEU A 17 -12.558 -1.907 6.644 1.00 62.15 H new ATOM 0 HD13 LEU A 17 -12.821 -0.263 6.014 1.00 62.15 H new ATOM 0 HD21 LEU A 17 -10.983 -0.609 3.510 1.00 71.04 H new ATOM 0 HD22 LEU A 17 -10.893 0.826 4.559 1.00 71.04 H new ATOM 0 HD23 LEU A 17 -9.434 -0.146 4.255 1.00 71.04 H new ATOM 281 N GLU A 18 -10.495 -3.674 7.885 1.00 31.21 N ATOM 282 CA GLU A 18 -9.969 -5.028 7.618 1.00 1.42 C ATOM 283 C GLU A 18 -10.608 -5.574 6.328 1.00 64.13 C ATOM 284 O GLU A 18 -11.793 -5.340 6.065 1.00 60.24 O ATOM 285 CB GLU A 18 -10.207 -5.997 8.824 1.00 10.01 C ATOM 286 CG GLU A 18 -11.662 -6.483 9.072 1.00 3.01 C ATOM 287 CD GLU A 18 -12.645 -5.379 9.510 1.00 3.53 C ATOM 288 OE1 GLU A 18 -13.232 -4.697 8.642 1.00 53.31 O ATOM 289 OE2 GLU A 18 -12.854 -5.199 10.726 1.00 72.13 O ATOM 0 H GLU A 18 -11.512 -3.614 7.839 1.00 31.21 H new ATOM 0 HA GLU A 18 -8.889 -4.961 7.485 1.00 1.42 H new ATOM 0 HB2 GLU A 18 -9.578 -6.875 8.680 1.00 10.01 H new ATOM 0 HB3 GLU A 18 -9.858 -5.500 9.730 1.00 10.01 H new ATOM 0 HG2 GLU A 18 -12.038 -6.943 8.158 1.00 3.01 H new ATOM 0 HG3 GLU A 18 -11.646 -7.260 9.836 1.00 3.01 H new ATOM 296 N GLU A 19 -9.808 -6.273 5.517 1.00 74.10 N ATOM 297 CA GLU A 19 -10.277 -6.865 4.250 1.00 75.12 C ATOM 298 C GLU A 19 -9.325 -7.976 3.820 1.00 54.32 C ATOM 299 O GLU A 19 -8.136 -7.948 4.157 1.00 32.35 O ATOM 300 CB GLU A 19 -10.381 -5.769 3.145 1.00 34.23 C ATOM 301 CG GLU A 19 -10.954 -6.236 1.788 1.00 65.00 C ATOM 302 CD GLU A 19 -12.373 -6.827 1.892 1.00 51.34 C ATOM 303 OE1 GLU A 19 -13.338 -6.052 2.022 1.00 34.44 O ATOM 304 OE2 GLU A 19 -12.527 -8.070 1.849 1.00 2.12 O ATOM 0 H GLU A 19 -8.822 -6.446 5.714 1.00 74.10 H new ATOM 0 HA GLU A 19 -11.269 -7.291 4.399 1.00 75.12 H new ATOM 0 HB2 GLU A 19 -11.004 -4.958 3.522 1.00 34.23 H new ATOM 0 HB3 GLU A 19 -9.387 -5.355 2.975 1.00 34.23 H new ATOM 0 HG2 GLU A 19 -10.970 -5.391 1.099 1.00 65.00 H new ATOM 0 HG3 GLU A 19 -10.288 -6.984 1.359 1.00 65.00 H new ATOM 311 N ILE A 20 -9.858 -8.949 3.066 1.00 61.53 N ATOM 312 CA ILE A 20 -9.062 -9.998 2.454 1.00 73.22 C ATOM 313 C ILE A 20 -8.477 -9.432 1.142 1.00 0.42 C ATOM 314 O ILE A 20 -9.127 -9.435 0.089 1.00 70.22 O ATOM 315 CB ILE A 20 -9.948 -11.275 2.186 1.00 30.31 C ATOM 316 CG1 ILE A 20 -10.641 -11.777 3.495 1.00 61.04 C ATOM 317 CG2 ILE A 20 -9.126 -12.409 1.550 1.00 51.13 C ATOM 318 CD1 ILE A 20 -9.692 -12.297 4.569 1.00 52.22 C ATOM 0 H ILE A 20 -10.856 -9.022 2.869 1.00 61.53 H new ATOM 0 HA ILE A 20 -8.253 -10.307 3.116 1.00 73.22 H new ATOM 0 HB ILE A 20 -10.724 -10.979 1.480 1.00 30.31 H new ATOM 0 HG12 ILE A 20 -11.227 -10.959 3.914 1.00 61.04 H new ATOM 0 HG13 ILE A 20 -11.342 -12.571 3.236 1.00 61.04 H new ATOM 0 HG21 ILE A 20 -9.769 -13.273 1.379 1.00 51.13 H new ATOM 0 HG22 ILE A 20 -8.713 -12.070 0.600 1.00 51.13 H new ATOM 0 HG23 ILE A 20 -8.313 -12.689 2.220 1.00 51.13 H new ATOM 0 HD11 ILE A 20 -10.267 -12.621 5.436 1.00 52.22 H new ATOM 0 HD12 ILE A 20 -9.123 -13.139 4.175 1.00 52.22 H new ATOM 0 HD13 ILE A 20 -9.007 -11.503 4.864 1.00 52.22 H new ATOM 330 N LEU A 21 -7.270 -8.881 1.249 1.00 4.43 N ATOM 331 CA LEU A 21 -6.539 -8.282 0.120 1.00 74.00 C ATOM 332 C LEU A 21 -5.539 -9.305 -0.432 1.00 22.53 C ATOM 333 O LEU A 21 -5.520 -10.459 -0.010 1.00 42.31 O ATOM 334 CB LEU A 21 -5.807 -6.989 0.571 1.00 21.24 C ATOM 335 CG LEU A 21 -6.702 -5.831 1.113 1.00 73.22 C ATOM 336 CD1 LEU A 21 -5.845 -4.660 1.633 1.00 3.14 C ATOM 337 CD2 LEU A 21 -7.701 -5.344 0.043 1.00 25.33 C ATOM 0 H LEU A 21 -6.760 -8.834 2.131 1.00 4.43 H new ATOM 0 HA LEU A 21 -7.245 -8.010 -0.665 1.00 74.00 H new ATOM 0 HB2 LEU A 21 -5.090 -7.257 1.347 1.00 21.24 H new ATOM 0 HB3 LEU A 21 -5.234 -6.609 -0.275 1.00 21.24 H new ATOM 0 HG LEU A 21 -7.276 -6.228 1.951 1.00 73.22 H new ATOM 0 HD11 LEU A 21 -6.497 -3.869 2.004 1.00 3.14 H new ATOM 0 HD12 LEU A 21 -5.203 -5.010 2.441 1.00 3.14 H new ATOM 0 HD13 LEU A 21 -5.229 -4.272 0.822 1.00 3.14 H new ATOM 0 HD21 LEU A 21 -8.309 -4.537 0.453 1.00 25.33 H new ATOM 0 HD22 LEU A 21 -7.154 -4.980 -0.827 1.00 25.33 H new ATOM 0 HD23 LEU A 21 -8.347 -6.170 -0.254 1.00 25.33 H new ATOM 349 N ILE A 22 -4.745 -8.878 -1.417 1.00 61.22 N ATOM 350 CA ILE A 22 -3.640 -9.678 -1.973 1.00 34.41 C ATOM 351 C ILE A 22 -2.331 -8.881 -1.861 1.00 0.12 C ATOM 352 O ILE A 22 -2.353 -7.659 -1.826 1.00 55.41 O ATOM 353 CB ILE A 22 -3.977 -10.149 -3.453 1.00 63.33 C ATOM 354 CG1 ILE A 22 -4.998 -11.341 -3.392 1.00 4.05 C ATOM 355 CG2 ILE A 22 -2.723 -10.515 -4.278 1.00 75.34 C ATOM 356 CD1 ILE A 22 -5.291 -12.040 -4.702 1.00 0.11 C ATOM 0 H ILE A 22 -4.847 -7.963 -1.857 1.00 61.22 H new ATOM 0 HA ILE A 22 -3.508 -10.594 -1.397 1.00 34.41 H new ATOM 0 HB ILE A 22 -4.427 -9.307 -3.978 1.00 63.33 H new ATOM 0 HG12 ILE A 22 -4.619 -12.081 -2.687 1.00 4.05 H new ATOM 0 HG13 ILE A 22 -5.938 -10.966 -2.986 1.00 4.05 H new ATOM 0 HG21 ILE A 22 -3.024 -10.828 -5.278 1.00 75.34 H new ATOM 0 HG22 ILE A 22 -2.069 -9.646 -4.351 1.00 75.34 H new ATOM 0 HG23 ILE A 22 -2.190 -11.330 -3.788 1.00 75.34 H new ATOM 0 HD11 ILE A 22 -6.008 -12.843 -4.533 1.00 0.11 H new ATOM 0 HD12 ILE A 22 -5.708 -11.325 -5.411 1.00 0.11 H new ATOM 0 HD13 ILE A 22 -4.368 -12.456 -5.107 1.00 0.11 H new ATOM 368 N LYS A 23 -1.202 -9.598 -1.758 1.00 71.32 N ATOM 369 CA LYS A 23 0.124 -8.998 -1.577 1.00 22.21 C ATOM 370 C LYS A 23 1.165 -9.814 -2.353 1.00 33.03 C ATOM 371 O LYS A 23 1.116 -11.058 -2.345 1.00 62.44 O ATOM 372 CB LYS A 23 0.461 -8.984 -0.067 1.00 14.03 C ATOM 373 CG LYS A 23 1.825 -8.358 0.303 1.00 71.34 C ATOM 374 CD LYS A 23 2.089 -8.370 1.826 1.00 53.55 C ATOM 375 CE LYS A 23 2.110 -9.784 2.430 1.00 2.14 C ATOM 376 NZ LYS A 23 3.239 -10.603 1.916 1.00 74.11 N ATOM 0 H LYS A 23 -1.186 -10.617 -1.798 1.00 71.32 H new ATOM 0 HA LYS A 23 0.132 -7.976 -1.957 1.00 22.21 H new ATOM 0 HB2 LYS A 23 -0.324 -8.439 0.458 1.00 14.03 H new ATOM 0 HB3 LYS A 23 0.439 -10.009 0.302 1.00 14.03 H new ATOM 0 HG2 LYS A 23 2.621 -8.903 -0.205 1.00 71.34 H new ATOM 0 HG3 LYS A 23 1.860 -7.331 -0.060 1.00 71.34 H new ATOM 0 HD2 LYS A 23 3.044 -7.883 2.026 1.00 53.55 H new ATOM 0 HD3 LYS A 23 1.320 -7.781 2.325 1.00 53.55 H new ATOM 0 HE2 LYS A 23 2.182 -9.712 3.515 1.00 2.14 H new ATOM 0 HE3 LYS A 23 1.169 -10.286 2.206 1.00 2.14 H new ATOM 0 HZ1 LYS A 23 3.220 -11.541 2.365 1.00 74.11 H new ATOM 0 HZ2 LYS A 23 3.149 -10.711 0.886 1.00 74.11 H new ATOM 0 HZ3 LYS A 23 4.139 -10.131 2.137 1.00 74.11 H new ATOM 390 N ARG A 24 2.099 -9.110 -3.016 1.00 2.21 N ATOM 391 CA ARG A 24 3.232 -9.743 -3.712 1.00 24.53 C ATOM 392 C ARG A 24 4.373 -9.985 -2.702 1.00 73.52 C ATOM 393 O ARG A 24 4.520 -9.237 -1.718 1.00 50.41 O ATOM 394 CB ARG A 24 3.736 -8.832 -4.870 1.00 72.24 C ATOM 395 CG ARG A 24 4.693 -9.529 -5.880 1.00 22.11 C ATOM 396 CD ARG A 24 5.570 -8.536 -6.665 1.00 45.35 C ATOM 397 NE ARG A 24 6.548 -7.872 -5.780 1.00 42.42 N ATOM 398 CZ ARG A 24 7.223 -6.746 -6.060 1.00 42.10 C ATOM 399 NH1 ARG A 24 7.060 -6.109 -7.223 1.00 41.55 N ATOM 400 NH2 ARG A 24 8.072 -6.264 -5.158 1.00 25.21 N ATOM 0 H ARG A 24 2.090 -8.092 -3.084 1.00 2.21 H new ATOM 0 HA ARG A 24 2.907 -10.693 -4.137 1.00 24.53 H new ATOM 0 HB2 ARG A 24 2.873 -8.449 -5.414 1.00 72.24 H new ATOM 0 HB3 ARG A 24 4.249 -7.972 -4.440 1.00 72.24 H new ATOM 0 HG2 ARG A 24 5.336 -10.225 -5.341 1.00 22.11 H new ATOM 0 HG3 ARG A 24 4.104 -10.118 -6.583 1.00 22.11 H new ATOM 0 HD2 ARG A 24 6.095 -9.062 -7.462 1.00 45.35 H new ATOM 0 HD3 ARG A 24 4.938 -7.786 -7.141 1.00 45.35 H new ATOM 0 HE ARG A 24 6.727 -8.308 -4.875 1.00 42.42 H new ATOM 0 HH11 ARG A 24 6.412 -6.477 -7.920 1.00 41.55 H new ATOM 0 HH12 ARG A 24 7.583 -5.255 -7.414 1.00 41.55 H new ATOM 0 HH21 ARG A 24 8.202 -6.749 -4.270 1.00 25.21 H new ATOM 0 HH22 ARG A 24 8.593 -5.409 -5.354 1.00 25.21 H new ATOM 414 N SER A 25 5.174 -11.024 -2.945 1.00 74.41 N ATOM 415 CA SER A 25 6.376 -11.305 -2.148 1.00 42.32 C ATOM 416 C SER A 25 7.551 -10.449 -2.648 1.00 42.10 C ATOM 417 O SER A 25 7.584 -10.039 -3.823 1.00 1.11 O ATOM 418 CB SER A 25 6.724 -12.802 -2.225 1.00 55.11 C ATOM 419 OG SER A 25 7.904 -13.117 -1.505 1.00 72.42 O ATOM 0 H SER A 25 5.011 -11.694 -3.697 1.00 74.41 H new ATOM 0 HA SER A 25 6.180 -11.050 -1.106 1.00 42.32 H new ATOM 0 HB2 SER A 25 5.893 -13.387 -1.830 1.00 55.11 H new ATOM 0 HB3 SER A 25 6.850 -13.090 -3.269 1.00 55.11 H new ATOM 0 HG SER A 25 8.086 -14.077 -1.579 1.00 72.42 H new ATOM 583 N ASN A 35 4.030 -13.636 -7.621 1.00 12.30 N ATOM 584 CA ASN A 35 3.041 -14.365 -6.833 1.00 32.54 C ATOM 585 C ASN A 35 2.058 -13.372 -6.197 1.00 20.12 C ATOM 586 O ASN A 35 2.455 -12.396 -5.548 1.00 2.22 O ATOM 587 CB ASN A 35 3.714 -15.291 -5.778 1.00 74.44 C ATOM 588 CG ASN A 35 4.513 -14.568 -4.684 1.00 60.25 C ATOM 589 OD1 ASN A 35 5.095 -13.504 -4.906 1.00 4.20 O ATOM 590 ND2 ASN A 35 4.555 -15.151 -3.489 1.00 70.04 N ATOM 0 HA ASN A 35 2.479 -15.025 -7.494 1.00 32.54 H new ATOM 0 HB2 ASN A 35 2.941 -15.893 -5.302 1.00 74.44 H new ATOM 0 HB3 ASN A 35 4.381 -15.980 -6.296 1.00 74.44 H new ATOM 0 HD21 ASN A 35 5.078 -14.718 -2.728 1.00 70.04 H new ATOM 0 HD22 ASN A 35 4.064 -16.031 -3.334 1.00 70.04 H new ATOM 597 N TYR A 36 0.770 -13.618 -6.431 1.00 61.22 N ATOM 598 CA TYR A 36 -0.317 -12.814 -5.880 1.00 43.42 C ATOM 599 C TYR A 36 -1.002 -13.671 -4.826 1.00 15.21 C ATOM 600 O TYR A 36 -1.718 -14.614 -5.167 1.00 73.41 O ATOM 601 CB TYR A 36 -1.299 -12.406 -7.012 1.00 52.24 C ATOM 602 CG TYR A 36 -0.611 -11.736 -8.214 1.00 73.34 C ATOM 603 CD1 TYR A 36 0.136 -10.565 -8.059 1.00 74.53 C ATOM 604 CD2 TYR A 36 -0.688 -12.288 -9.500 1.00 21.45 C ATOM 605 CE1 TYR A 36 0.771 -9.972 -9.134 1.00 5.41 C ATOM 606 CE2 TYR A 36 -0.051 -11.690 -10.575 1.00 44.42 C ATOM 607 CZ TYR A 36 0.674 -10.535 -10.386 1.00 44.25 C ATOM 608 OH TYR A 36 1.305 -9.932 -11.453 1.00 23.12 O ATOM 0 H TYR A 36 0.449 -14.390 -7.015 1.00 61.22 H new ATOM 0 HA TYR A 36 0.050 -11.891 -5.432 1.00 43.42 H new ATOM 0 HB2 TYR A 36 -1.831 -13.293 -7.357 1.00 52.24 H new ATOM 0 HB3 TYR A 36 -2.046 -11.724 -6.605 1.00 52.24 H new ATOM 0 HD1 TYR A 36 0.219 -10.115 -7.081 1.00 74.53 H new ATOM 0 HD2 TYR A 36 -1.254 -13.195 -9.655 1.00 21.45 H new ATOM 0 HE1 TYR A 36 1.343 -9.067 -8.991 1.00 5.41 H new ATOM 0 HE2 TYR A 36 -0.123 -12.129 -11.559 1.00 44.42 H new ATOM 0 HH TYR A 36 1.141 -10.453 -12.267 1.00 23.12 H new ATOM 618 N LYS A 37 -0.744 -13.370 -3.543 1.00 1.33 N ATOM 619 CA LYS A 37 -1.184 -14.231 -2.436 1.00 64.23 C ATOM 620 C LYS A 37 -2.279 -13.545 -1.611 1.00 54.41 C ATOM 621 O LYS A 37 -2.120 -12.403 -1.184 1.00 60.04 O ATOM 622 CB LYS A 37 0.029 -14.632 -1.551 1.00 12.43 C ATOM 623 CG LYS A 37 -0.277 -15.724 -0.491 1.00 30.21 C ATOM 624 CD LYS A 37 -0.843 -17.033 -1.103 1.00 73.04 C ATOM 625 CE LYS A 37 0.101 -17.693 -2.123 1.00 42.02 C ATOM 626 NZ LYS A 37 -0.547 -18.840 -2.822 1.00 4.33 N ATOM 0 H LYS A 37 -0.233 -12.538 -3.248 1.00 1.33 H new ATOM 0 HA LYS A 37 -1.614 -15.142 -2.853 1.00 64.23 H new ATOM 0 HB2 LYS A 37 0.832 -14.987 -2.197 1.00 12.43 H new ATOM 0 HB3 LYS A 37 0.399 -13.743 -1.041 1.00 12.43 H new ATOM 0 HG2 LYS A 37 0.636 -15.953 0.058 1.00 30.21 H new ATOM 0 HG3 LYS A 37 -0.992 -15.330 0.231 1.00 30.21 H new ATOM 0 HD2 LYS A 37 -1.049 -17.741 -0.300 1.00 73.04 H new ATOM 0 HD3 LYS A 37 -1.795 -16.816 -1.588 1.00 73.04 H new ATOM 0 HE2 LYS A 37 0.416 -16.952 -2.858 1.00 42.02 H new ATOM 0 HE3 LYS A 37 1.000 -18.040 -1.614 1.00 42.02 H new ATOM 0 HZ1 LYS A 37 0.123 -19.256 -3.500 1.00 4.33 H new ATOM 0 HZ2 LYS A 37 -0.825 -19.559 -2.124 1.00 4.33 H new ATOM 0 HZ3 LYS A 37 -1.391 -18.505 -3.330 1.00 4.33 H new ATOM 640 N GLU A 38 -3.359 -14.299 -1.362 1.00 43.03 N ATOM 641 CA GLU A 38 -4.578 -13.808 -0.715 1.00 34.15 C ATOM 642 C GLU A 38 -4.411 -13.877 0.811 1.00 41.12 C ATOM 643 O GLU A 38 -4.277 -14.976 1.369 1.00 32.55 O ATOM 644 CB GLU A 38 -5.784 -14.665 -1.190 1.00 72.41 C ATOM 645 CG GLU A 38 -7.132 -14.282 -0.563 1.00 25.13 C ATOM 646 CD GLU A 38 -8.260 -15.285 -0.860 1.00 1.55 C ATOM 647 OE1 GLU A 38 -8.356 -16.309 -0.149 1.00 70.11 O ATOM 648 OE2 GLU A 38 -9.039 -15.070 -1.808 1.00 63.34 O ATOM 0 H GLU A 38 -3.408 -15.287 -1.611 1.00 43.03 H new ATOM 0 HA GLU A 38 -4.762 -12.769 -0.989 1.00 34.15 H new ATOM 0 HB2 GLU A 38 -5.866 -14.582 -2.274 1.00 72.41 H new ATOM 0 HB3 GLU A 38 -5.579 -15.712 -0.965 1.00 72.41 H new ATOM 0 HG2 GLU A 38 -7.009 -14.196 0.517 1.00 25.13 H new ATOM 0 HG3 GLU A 38 -7.427 -13.299 -0.929 1.00 25.13 H new ATOM 655 N ARG A 39 -4.427 -12.699 1.474 1.00 10.24 N ATOM 656 CA ARG A 39 -4.199 -12.567 2.927 1.00 3.22 C ATOM 657 C ARG A 39 -5.153 -11.545 3.562 1.00 71.23 C ATOM 658 O ARG A 39 -5.729 -10.700 2.879 1.00 20.45 O ATOM 659 CB ARG A 39 -2.709 -12.203 3.278 1.00 4.14 C ATOM 660 CG ARG A 39 -1.667 -13.336 3.067 1.00 13.42 C ATOM 661 CD ARG A 39 -2.119 -14.705 3.642 1.00 33.14 C ATOM 662 NE ARG A 39 -2.810 -14.588 4.950 1.00 74.54 N ATOM 663 CZ ARG A 39 -4.020 -15.108 5.246 1.00 41.03 C ATOM 664 NH1 ARG A 39 -4.708 -15.790 4.345 1.00 12.14 N ATOM 665 NH2 ARG A 39 -4.552 -14.928 6.444 1.00 61.14 N ATOM 0 H ARG A 39 -4.600 -11.807 1.010 1.00 10.24 H new ATOM 0 HA ARG A 39 -4.407 -13.550 3.350 1.00 3.22 H new ATOM 0 HB2 ARG A 39 -2.413 -11.346 2.674 1.00 4.14 H new ATOM 0 HB3 ARG A 39 -2.668 -11.887 4.321 1.00 4.14 H new ATOM 0 HG2 ARG A 39 -1.471 -13.445 2.000 1.00 13.42 H new ATOM 0 HG3 ARG A 39 -0.726 -13.046 3.536 1.00 13.42 H new ATOM 0 HD2 ARG A 39 -2.785 -15.190 2.928 1.00 33.14 H new ATOM 0 HD3 ARG A 39 -1.248 -15.350 3.755 1.00 33.14 H new ATOM 0 HE ARG A 39 -2.330 -14.071 5.687 1.00 74.54 H new ATOM 0 HH11 ARG A 39 -4.325 -15.930 3.410 1.00 12.14 H new ATOM 0 HH12 ARG A 39 -5.621 -16.176 4.586 1.00 12.14 H new ATOM 0 HH21 ARG A 39 -4.047 -14.393 7.151 1.00 61.14 H new ATOM 0 HH22 ARG A 39 -5.467 -15.324 6.661 1.00 61.14 H new ATOM 679 N LEU A 40 -5.285 -11.642 4.903 1.00 74.11 N ATOM 680 CA LEU A 40 -6.112 -10.723 5.704 1.00 13.32 C ATOM 681 C LEU A 40 -5.238 -9.560 6.201 1.00 32.04 C ATOM 682 O LEU A 40 -4.265 -9.771 6.934 1.00 3.23 O ATOM 683 CB LEU A 40 -6.764 -11.461 6.916 1.00 34.44 C ATOM 684 CG LEU A 40 -7.587 -10.557 7.902 1.00 71.05 C ATOM 685 CD1 LEU A 40 -8.753 -9.814 7.194 1.00 21.50 C ATOM 686 CD2 LEU A 40 -8.098 -11.378 9.107 1.00 22.35 C ATOM 0 H LEU A 40 -4.820 -12.361 5.457 1.00 74.11 H new ATOM 0 HA LEU A 40 -6.916 -10.339 5.077 1.00 13.32 H new ATOM 0 HB2 LEU A 40 -7.422 -12.240 6.532 1.00 34.44 H new ATOM 0 HB3 LEU A 40 -5.976 -11.959 7.481 1.00 34.44 H new ATOM 0 HG LEU A 40 -6.907 -9.790 8.273 1.00 71.05 H new ATOM 0 HD11 LEU A 40 -9.290 -9.203 7.920 1.00 21.50 H new ATOM 0 HD12 LEU A 40 -8.353 -9.174 6.407 1.00 21.50 H new ATOM 0 HD13 LEU A 40 -9.436 -10.542 6.757 1.00 21.50 H new ATOM 0 HD21 LEU A 40 -8.665 -10.729 9.775 1.00 22.35 H new ATOM 0 HD22 LEU A 40 -8.740 -12.184 8.752 1.00 22.35 H new ATOM 0 HD23 LEU A 40 -7.250 -11.801 9.645 1.00 22.35 H new ATOM 698 N PHE A 41 -5.590 -8.344 5.775 1.00 4.13 N ATOM 699 CA PHE A 41 -4.955 -7.102 6.236 1.00 54.32 C ATOM 700 C PHE A 41 -5.842 -6.436 7.285 1.00 73.15 C ATOM 701 O PHE A 41 -7.026 -6.187 7.037 1.00 25.10 O ATOM 702 CB PHE A 41 -4.714 -6.150 5.038 1.00 4.01 C ATOM 703 CG PHE A 41 -3.528 -6.564 4.164 1.00 32.14 C ATOM 704 CD1 PHE A 41 -3.593 -7.699 3.350 1.00 13.53 C ATOM 705 CD2 PHE A 41 -2.337 -5.835 4.182 1.00 22.25 C ATOM 706 CE1 PHE A 41 -2.512 -8.081 2.580 1.00 3.13 C ATOM 707 CE2 PHE A 41 -1.258 -6.224 3.417 1.00 50.43 C ATOM 708 CZ PHE A 41 -1.349 -7.342 2.619 1.00 20.45 C ATOM 0 H PHE A 41 -6.332 -8.190 5.092 1.00 4.13 H new ATOM 0 HA PHE A 41 -3.990 -7.333 6.686 1.00 54.32 H new ATOM 0 HB2 PHE A 41 -5.614 -6.115 4.424 1.00 4.01 H new ATOM 0 HB3 PHE A 41 -4.545 -5.141 5.413 1.00 4.01 H new ATOM 0 HD1 PHE A 41 -4.500 -8.284 3.323 1.00 13.53 H new ATOM 0 HD2 PHE A 41 -2.260 -4.955 4.803 1.00 22.25 H new ATOM 0 HE1 PHE A 41 -2.578 -8.955 1.950 1.00 3.13 H new ATOM 0 HE2 PHE A 41 -0.342 -5.652 3.444 1.00 50.43 H new ATOM 0 HZ PHE A 41 -0.503 -7.642 2.019 1.00 20.45 H new ATOM 718 N VAL A 42 -5.257 -6.179 8.458 1.00 42.22 N ATOM 719 CA VAL A 42 -5.907 -5.473 9.564 1.00 21.40 C ATOM 720 C VAL A 42 -5.122 -4.175 9.811 1.00 71.20 C ATOM 721 O VAL A 42 -3.940 -4.220 10.177 1.00 61.00 O ATOM 722 CB VAL A 42 -5.931 -6.364 10.870 1.00 13.34 C ATOM 723 CG1 VAL A 42 -6.566 -5.612 12.066 1.00 34.33 C ATOM 724 CG2 VAL A 42 -6.652 -7.715 10.612 1.00 24.20 C ATOM 0 H VAL A 42 -4.300 -6.462 8.669 1.00 42.22 H new ATOM 0 HA VAL A 42 -6.943 -5.251 9.309 1.00 21.40 H new ATOM 0 HB VAL A 42 -4.896 -6.580 11.135 1.00 13.34 H new ATOM 0 HG11 VAL A 42 -6.564 -6.258 12.944 1.00 34.33 H new ATOM 0 HG12 VAL A 42 -5.990 -4.711 12.277 1.00 34.33 H new ATOM 0 HG13 VAL A 42 -7.592 -5.337 11.820 1.00 34.33 H new ATOM 0 HG21 VAL A 42 -6.654 -8.307 11.527 1.00 24.20 H new ATOM 0 HG22 VAL A 42 -7.679 -7.526 10.301 1.00 24.20 H new ATOM 0 HG23 VAL A 42 -6.130 -8.262 9.827 1.00 24.20 H new ATOM 734 N LEU A 43 -5.771 -3.025 9.601 1.00 31.35 N ATOM 735 CA LEU A 43 -5.148 -1.712 9.799 1.00 3.44 C ATOM 736 C LEU A 43 -5.610 -1.174 11.147 1.00 0.45 C ATOM 737 O LEU A 43 -6.744 -0.743 11.284 1.00 10.14 O ATOM 738 CB LEU A 43 -5.568 -0.741 8.651 1.00 3.13 C ATOM 739 CG LEU A 43 -5.152 0.762 8.814 1.00 13.31 C ATOM 740 CD1 LEU A 43 -3.620 0.934 8.911 1.00 11.33 C ATOM 741 CD2 LEU A 43 -5.757 1.634 7.685 1.00 54.53 C ATOM 0 H LEU A 43 -6.741 -2.978 9.290 1.00 31.35 H new ATOM 0 HA LEU A 43 -4.062 -1.799 9.783 1.00 3.44 H new ATOM 0 HB2 LEU A 43 -5.143 -1.113 7.718 1.00 3.13 H new ATOM 0 HB3 LEU A 43 -6.652 -0.785 8.547 1.00 3.13 H new ATOM 0 HG LEU A 43 -5.565 1.112 9.760 1.00 13.31 H new ATOM 0 HD11 LEU A 43 -3.379 1.991 9.023 1.00 11.33 H new ATOM 0 HD12 LEU A 43 -3.246 0.383 9.774 1.00 11.33 H new ATOM 0 HD13 LEU A 43 -3.153 0.549 8.005 1.00 11.33 H new ATOM 0 HD21 LEU A 43 -5.452 2.671 7.823 1.00 54.53 H new ATOM 0 HD22 LEU A 43 -5.401 1.277 6.719 1.00 54.53 H new ATOM 0 HD23 LEU A 43 -6.845 1.568 7.718 1.00 54.53 H new ATOM 753 N THR A 44 -4.724 -1.225 12.141 1.00 20.34 N ATOM 754 CA THR A 44 -4.946 -0.580 13.440 1.00 21.03 C ATOM 755 C THR A 44 -4.388 0.852 13.390 1.00 51.22 C ATOM 756 O THR A 44 -3.702 1.240 12.428 1.00 40.13 O ATOM 757 CB THR A 44 -4.277 -1.392 14.608 1.00 12.44 C ATOM 758 OG1 THR A 44 -2.855 -1.482 14.415 1.00 52.33 O ATOM 759 CG2 THR A 44 -4.866 -2.814 14.728 1.00 24.42 C ATOM 0 H THR A 44 -3.832 -1.714 12.071 1.00 20.34 H new ATOM 0 HA THR A 44 -6.017 -0.552 13.639 1.00 21.03 H new ATOM 0 HB THR A 44 -4.487 -0.852 15.531 1.00 12.44 H new ATOM 0 HG1 THR A 44 -2.640 -1.298 13.477 1.00 52.33 H new ATOM 0 HG21 THR A 44 -4.377 -3.342 15.547 1.00 24.42 H new ATOM 0 HG22 THR A 44 -5.936 -2.749 14.926 1.00 24.42 H new ATOM 0 HG23 THR A 44 -4.701 -3.356 13.797 1.00 24.42 H new ATOM 767 N LYS A 45 -4.653 1.615 14.448 1.00 12.23 N ATOM 768 CA LYS A 45 -4.289 3.040 14.526 1.00 21.53 C ATOM 769 C LYS A 45 -2.786 3.225 14.808 1.00 30.12 C ATOM 770 O LYS A 45 -2.253 4.327 14.668 1.00 31.11 O ATOM 771 CB LYS A 45 -5.164 3.707 15.615 1.00 62.22 C ATOM 772 CG LYS A 45 -6.679 3.495 15.380 1.00 74.14 C ATOM 773 CD LYS A 45 -7.545 4.036 16.530 1.00 11.22 C ATOM 774 CE LYS A 45 -9.041 3.796 16.289 1.00 43.42 C ATOM 775 NZ LYS A 45 -9.874 4.339 17.391 1.00 43.14 N ATOM 0 H LYS A 45 -5.128 1.267 15.281 1.00 12.23 H new ATOM 0 HA LYS A 45 -4.477 3.520 13.566 1.00 21.53 H new ATOM 0 HB2 LYS A 45 -4.892 3.304 16.590 1.00 62.22 H new ATOM 0 HB3 LYS A 45 -4.951 4.776 15.642 1.00 62.22 H new ATOM 0 HG2 LYS A 45 -6.970 3.986 14.451 1.00 74.14 H new ATOM 0 HG3 LYS A 45 -6.876 2.431 15.253 1.00 74.14 H new ATOM 0 HD2 LYS A 45 -7.247 3.558 17.463 1.00 11.22 H new ATOM 0 HD3 LYS A 45 -7.364 5.104 16.648 1.00 11.22 H new ATOM 0 HE2 LYS A 45 -9.336 4.261 15.348 1.00 43.42 H new ATOM 0 HE3 LYS A 45 -9.225 2.726 16.188 1.00 43.42 H new ATOM 0 HZ1 LYS A 45 -10.878 4.156 17.190 1.00 43.14 H new ATOM 0 HZ2 LYS A 45 -9.611 3.878 18.285 1.00 43.14 H new ATOM 0 HZ3 LYS A 45 -9.718 5.364 17.471 1.00 43.14 H new ATOM 789 N SER A 46 -2.115 2.129 15.198 1.00 40.21 N ATOM 790 CA SER A 46 -0.672 2.116 15.481 1.00 23.12 C ATOM 791 C SER A 46 0.105 1.464 14.321 1.00 64.42 C ATOM 792 O SER A 46 1.202 1.920 13.960 1.00 33.04 O ATOM 793 CB SER A 46 -0.419 1.351 16.802 1.00 52.05 C ATOM 794 OG SER A 46 -1.213 1.885 17.856 1.00 41.43 O ATOM 0 H SER A 46 -2.562 1.221 15.326 1.00 40.21 H new ATOM 0 HA SER A 46 -0.318 3.142 15.584 1.00 23.12 H new ATOM 0 HB2 SER A 46 -0.651 0.295 16.666 1.00 52.05 H new ATOM 0 HB3 SER A 46 0.636 1.414 17.068 1.00 52.05 H new ATOM 0 HG SER A 46 -1.039 1.386 18.681 1.00 41.43 H new ATOM 800 N MET A 47 -0.486 0.402 13.713 1.00 2.43 N ATOM 801 CA MET A 47 0.207 -0.443 12.704 1.00 62.44 C ATOM 802 C MET A 47 -0.741 -0.915 11.582 1.00 1.24 C ATOM 803 O MET A 47 -1.923 -1.131 11.802 1.00 74.25 O ATOM 804 CB MET A 47 0.854 -1.709 13.372 1.00 42.43 C ATOM 805 CG MET A 47 2.028 -1.436 14.321 1.00 63.13 C ATOM 806 SD MET A 47 2.756 -2.954 14.983 1.00 11.20 S ATOM 807 CE MET A 47 1.369 -3.706 15.849 1.00 64.24 C ATOM 0 H MET A 47 -1.444 0.110 13.905 1.00 2.43 H new ATOM 0 HA MET A 47 0.982 0.187 12.268 1.00 62.44 H new ATOM 0 HB2 MET A 47 0.080 -2.240 13.926 1.00 42.43 H new ATOM 0 HB3 MET A 47 1.197 -2.378 12.583 1.00 42.43 H new ATOM 0 HG2 MET A 47 2.795 -0.871 13.791 1.00 63.13 H new ATOM 0 HG3 MET A 47 1.685 -0.812 15.146 1.00 63.13 H new ATOM 0 HE1 MET A 47 1.736 -4.489 16.512 1.00 64.24 H new ATOM 0 HE2 MET A 47 0.852 -2.947 16.436 1.00 64.24 H new ATOM 0 HE3 MET A 47 0.679 -4.138 15.124 1.00 64.24 H new ATOM 817 N LEU A 48 -0.180 -1.078 10.375 1.00 23.22 N ATOM 818 CA LEU A 48 -0.794 -1.868 9.297 1.00 10.23 C ATOM 819 C LEU A 48 -0.158 -3.266 9.348 1.00 12.05 C ATOM 820 O LEU A 48 0.998 -3.453 8.952 1.00 21.52 O ATOM 821 CB LEU A 48 -0.560 -1.194 7.911 1.00 3.30 C ATOM 822 CG LEU A 48 -1.056 -1.991 6.651 1.00 31.22 C ATOM 823 CD1 LEU A 48 -2.581 -2.266 6.700 1.00 53.33 C ATOM 824 CD2 LEU A 48 -0.649 -1.262 5.343 1.00 41.13 C ATOM 0 H LEU A 48 0.716 -0.664 10.118 1.00 23.22 H new ATOM 0 HA LEU A 48 -1.874 -1.934 9.432 1.00 10.23 H new ATOM 0 HB2 LEU A 48 -1.054 -0.222 7.916 1.00 3.30 H new ATOM 0 HB3 LEU A 48 0.508 -1.008 7.798 1.00 3.30 H new ATOM 0 HG LEU A 48 -0.563 -2.963 6.662 1.00 31.22 H new ATOM 0 HD11 LEU A 48 -2.880 -2.819 5.809 1.00 53.33 H new ATOM 0 HD12 LEU A 48 -2.817 -2.853 7.588 1.00 53.33 H new ATOM 0 HD13 LEU A 48 -3.120 -1.320 6.737 1.00 53.33 H new ATOM 0 HD21 LEU A 48 -1.003 -1.832 4.484 1.00 41.13 H new ATOM 0 HD22 LEU A 48 -1.094 -0.267 5.327 1.00 41.13 H new ATOM 0 HD23 LEU A 48 0.437 -1.174 5.298 1.00 41.13 H new ATOM 836 N THR A 49 -0.901 -4.231 9.905 1.00 43.31 N ATOM 837 CA THR A 49 -0.405 -5.599 10.122 1.00 43.11 C ATOM 838 C THR A 49 -1.268 -6.605 9.347 1.00 45.20 C ATOM 839 O THR A 49 -2.491 -6.633 9.497 1.00 75.53 O ATOM 840 CB THR A 49 -0.410 -5.961 11.648 1.00 51.13 C ATOM 841 OG1 THR A 49 0.323 -4.967 12.383 1.00 70.03 O ATOM 842 CG2 THR A 49 0.217 -7.345 11.921 1.00 52.44 C ATOM 0 H THR A 49 -1.861 -4.087 10.218 1.00 43.31 H new ATOM 0 HA THR A 49 0.621 -5.649 9.757 1.00 43.11 H new ATOM 0 HB THR A 49 -1.451 -5.990 11.970 1.00 51.13 H new ATOM 0 HG1 THR A 49 0.454 -5.273 13.305 1.00 70.03 H new ATOM 0 HG21 THR A 49 0.191 -7.552 12.991 1.00 52.44 H new ATOM 0 HG22 THR A 49 -0.347 -8.111 11.390 1.00 52.44 H new ATOM 0 HG23 THR A 49 1.251 -7.351 11.575 1.00 52.44 H new ATOM 850 N TYR A 50 -0.613 -7.431 8.535 1.00 11.21 N ATOM 851 CA TYR A 50 -1.263 -8.513 7.793 1.00 35.24 C ATOM 852 C TYR A 50 -0.975 -9.833 8.512 1.00 72.12 C ATOM 853 O TYR A 50 0.167 -10.091 8.893 1.00 24.45 O ATOM 854 CB TYR A 50 -0.758 -8.543 6.322 1.00 10.50 C ATOM 855 CG TYR A 50 0.785 -8.517 6.150 1.00 33.43 C ATOM 856 CD1 TYR A 50 1.537 -9.699 6.134 1.00 72.13 C ATOM 857 CD2 TYR A 50 1.491 -7.307 6.012 1.00 72.51 C ATOM 858 CE1 TYR A 50 2.910 -9.676 5.991 1.00 30.24 C ATOM 859 CE2 TYR A 50 2.870 -7.289 5.865 1.00 62.43 C ATOM 860 CZ TYR A 50 3.570 -8.477 5.856 1.00 10.55 C ATOM 861 OH TYR A 50 4.944 -8.464 5.713 1.00 44.14 O ATOM 0 H TYR A 50 0.392 -7.369 8.371 1.00 11.21 H new ATOM 0 HA TYR A 50 -2.341 -8.352 7.758 1.00 35.24 H new ATOM 0 HB2 TYR A 50 -1.146 -9.441 5.840 1.00 10.50 H new ATOM 0 HB3 TYR A 50 -1.181 -7.689 5.793 1.00 10.50 H new ATOM 0 HD1 TYR A 50 1.032 -10.648 6.236 1.00 72.13 H new ATOM 0 HD2 TYR A 50 0.948 -6.374 6.021 1.00 72.51 H new ATOM 0 HE1 TYR A 50 3.467 -10.601 5.985 1.00 30.24 H new ATOM 0 HE2 TYR A 50 3.393 -6.350 5.758 1.00 62.43 H new ATOM 0 HH TYR A 50 5.255 -7.539 5.628 1.00 44.14 H new ATOM 871 N TYR A 51 -2.024 -10.628 8.752 1.00 21.14 N ATOM 872 CA TYR A 51 -1.892 -11.947 9.404 1.00 61.24 C ATOM 873 C TYR A 51 -2.067 -13.083 8.387 1.00 52.12 C ATOM 874 O TYR A 51 -2.772 -12.935 7.382 1.00 12.22 O ATOM 875 CB TYR A 51 -2.933 -12.066 10.539 1.00 2.15 C ATOM 876 CG TYR A 51 -2.748 -11.028 11.654 1.00 65.53 C ATOM 877 CD1 TYR A 51 -1.829 -11.236 12.683 1.00 73.43 C ATOM 878 CD2 TYR A 51 -3.489 -9.840 11.673 1.00 72.53 C ATOM 879 CE1 TYR A 51 -1.658 -10.306 13.689 1.00 20.21 C ATOM 880 CE2 TYR A 51 -3.320 -8.906 12.683 1.00 25.04 C ATOM 881 CZ TYR A 51 -2.404 -9.144 13.687 1.00 21.03 C ATOM 882 OH TYR A 51 -2.234 -8.221 14.702 1.00 25.42 O ATOM 0 H TYR A 51 -2.983 -10.383 8.504 1.00 21.14 H new ATOM 0 HA TYR A 51 -0.891 -12.033 9.826 1.00 61.24 H new ATOM 0 HB2 TYR A 51 -3.932 -11.959 10.117 1.00 2.15 H new ATOM 0 HB3 TYR A 51 -2.875 -13.065 10.971 1.00 2.15 H new ATOM 0 HD1 TYR A 51 -1.240 -12.141 12.693 1.00 73.43 H new ATOM 0 HD2 TYR A 51 -4.205 -9.648 10.887 1.00 72.53 H new ATOM 0 HE1 TYR A 51 -0.942 -10.487 14.477 1.00 20.21 H new ATOM 0 HE2 TYR A 51 -3.902 -7.996 12.684 1.00 25.04 H new ATOM 0 HH TYR A 51 -2.832 -7.459 14.554 1.00 25.42 H new ATOM 1081 N PHE A 63 4.968 -6.703 9.889 1.00 15.34 N ATOM 1082 CA PHE A 63 4.066 -5.611 10.274 1.00 34.12 C ATOM 1083 C PHE A 63 4.714 -4.273 9.885 1.00 32.33 C ATOM 1084 O PHE A 63 5.936 -4.208 9.693 1.00 4.53 O ATOM 1085 CB PHE A 63 3.674 -5.676 11.793 1.00 40.13 C ATOM 1086 CG PHE A 63 4.799 -5.726 12.851 1.00 64.21 C ATOM 1087 CD1 PHE A 63 6.160 -5.712 12.522 1.00 41.10 C ATOM 1088 CD2 PHE A 63 4.467 -5.785 14.207 1.00 51.31 C ATOM 1089 CE1 PHE A 63 7.136 -5.756 13.499 1.00 63.11 C ATOM 1090 CE2 PHE A 63 5.447 -5.828 15.184 1.00 72.12 C ATOM 1091 CZ PHE A 63 6.780 -5.812 14.825 1.00 10.32 C ATOM 0 HA PHE A 63 3.125 -5.713 9.733 1.00 34.12 H new ATOM 0 HB2 PHE A 63 3.054 -4.806 12.011 1.00 40.13 H new ATOM 0 HB3 PHE A 63 3.048 -6.557 11.935 1.00 40.13 H new ATOM 0 HD1 PHE A 63 6.453 -5.666 11.483 1.00 41.10 H new ATOM 0 HD2 PHE A 63 3.427 -5.797 14.498 1.00 51.31 H new ATOM 0 HE1 PHE A 63 8.179 -5.746 13.220 1.00 63.11 H new ATOM 0 HE2 PHE A 63 5.169 -5.874 16.227 1.00 72.12 H new ATOM 0 HZ PHE A 63 7.544 -5.844 15.588 1.00 10.32 H new ATOM 1101 N ILE A 64 3.894 -3.237 9.714 1.00 32.13 N ATOM 1102 CA ILE A 64 4.362 -1.883 9.378 1.00 51.33 C ATOM 1103 C ILE A 64 3.795 -0.903 10.411 1.00 14.40 C ATOM 1104 O ILE A 64 2.612 -0.966 10.710 1.00 71.35 O ATOM 1105 CB ILE A 64 3.884 -1.443 7.937 1.00 45.05 C ATOM 1106 CG1 ILE A 64 4.324 -2.482 6.852 1.00 2.24 C ATOM 1107 CG2 ILE A 64 4.411 -0.024 7.593 1.00 22.21 C ATOM 1108 CD1 ILE A 64 3.810 -2.179 5.461 1.00 45.42 C ATOM 0 H ILE A 64 2.880 -3.308 9.804 1.00 32.13 H new ATOM 0 HA ILE A 64 5.452 -1.880 9.388 1.00 51.33 H new ATOM 0 HB ILE A 64 2.795 -1.410 7.941 1.00 45.05 H new ATOM 0 HG12 ILE A 64 5.413 -2.523 6.824 1.00 2.24 H new ATOM 0 HG13 ILE A 64 3.975 -3.471 7.149 1.00 2.24 H new ATOM 0 HG21 ILE A 64 4.070 0.259 6.597 1.00 22.21 H new ATOM 0 HG22 ILE A 64 4.033 0.692 8.323 1.00 22.21 H new ATOM 0 HG23 ILE A 64 5.501 -0.025 7.617 1.00 22.21 H new ATOM 0 HD11 ILE A 64 4.159 -2.945 4.769 1.00 45.42 H new ATOM 0 HD12 ILE A 64 2.720 -2.168 5.470 1.00 45.42 H new ATOM 0 HD13 ILE A 64 4.180 -1.205 5.140 1.00 45.42 H new ATOM 1120 N ASP A 65 4.634 -0.006 10.944 1.00 52.45 N ATOM 1121 CA ASP A 65 4.166 1.115 11.784 1.00 72.32 C ATOM 1122 C ASP A 65 3.636 2.211 10.856 1.00 14.21 C ATOM 1123 O ASP A 65 4.294 2.535 9.859 1.00 62.32 O ATOM 1124 CB ASP A 65 5.318 1.680 12.643 1.00 41.51 C ATOM 1125 CG ASP A 65 5.846 0.669 13.659 1.00 33.24 C ATOM 1126 OD1 ASP A 65 5.245 0.536 14.741 1.00 70.52 O ATOM 1127 OD2 ASP A 65 6.842 -0.023 13.367 1.00 32.04 O ATOM 0 H ASP A 65 5.645 -0.031 10.810 1.00 52.45 H new ATOM 0 HA ASP A 65 3.385 0.763 12.458 1.00 72.32 H new ATOM 0 HB2 ASP A 65 6.133 1.992 11.990 1.00 41.51 H new ATOM 0 HB3 ASP A 65 4.971 2.570 13.168 1.00 41.51 H new ATOM 1132 N VAL A 66 2.463 2.776 11.192 1.00 2.20 N ATOM 1133 CA VAL A 66 1.848 3.869 10.414 1.00 51.43 C ATOM 1134 C VAL A 66 2.772 5.109 10.396 1.00 74.22 C ATOM 1135 O VAL A 66 2.888 5.805 9.375 1.00 0.43 O ATOM 1136 CB VAL A 66 0.425 4.252 10.971 1.00 15.21 C ATOM 1137 CG1 VAL A 66 -0.189 5.416 10.159 1.00 43.13 C ATOM 1138 CG2 VAL A 66 -0.522 3.021 10.978 1.00 22.13 C ATOM 0 H VAL A 66 1.917 2.491 12.005 1.00 2.20 H new ATOM 0 HA VAL A 66 1.718 3.511 9.393 1.00 51.43 H new ATOM 0 HB VAL A 66 0.547 4.586 12.001 1.00 15.21 H new ATOM 0 HG11 VAL A 66 -1.171 5.663 10.562 1.00 43.13 H new ATOM 0 HG12 VAL A 66 0.460 6.289 10.226 1.00 43.13 H new ATOM 0 HG13 VAL A 66 -0.290 5.118 9.115 1.00 43.13 H new ATOM 0 HG21 VAL A 66 -1.497 3.314 11.367 1.00 22.13 H new ATOM 0 HG22 VAL A 66 -0.636 2.643 9.962 1.00 22.13 H new ATOM 0 HG23 VAL A 66 -0.099 2.240 11.610 1.00 22.13 H new ATOM 1148 N SER A 67 3.463 5.315 11.527 1.00 24.24 N ATOM 1149 CA SER A 67 4.438 6.404 11.712 1.00 32.41 C ATOM 1150 C SER A 67 5.656 6.232 10.782 1.00 11.11 C ATOM 1151 O SER A 67 6.241 7.216 10.315 1.00 2.14 O ATOM 1152 CB SER A 67 4.894 6.443 13.186 1.00 51.43 C ATOM 1153 OG SER A 67 3.773 6.478 14.054 1.00 50.25 O ATOM 0 H SER A 67 3.360 4.723 12.351 1.00 24.24 H new ATOM 0 HA SER A 67 3.955 7.346 11.454 1.00 32.41 H new ATOM 0 HB2 SER A 67 5.505 5.567 13.407 1.00 51.43 H new ATOM 0 HB3 SER A 67 5.520 7.319 13.356 1.00 51.43 H new ATOM 0 HG SER A 67 4.080 6.501 14.984 1.00 50.25 H new ATOM 1159 N LYS A 68 6.000 4.965 10.503 1.00 51.14 N ATOM 1160 CA LYS A 68 7.171 4.592 9.692 1.00 10.34 C ATOM 1161 C LYS A 68 6.856 4.577 8.184 1.00 35.15 C ATOM 1162 O LYS A 68 7.766 4.384 7.370 1.00 74.51 O ATOM 1163 CB LYS A 68 7.712 3.209 10.155 1.00 31.41 C ATOM 1164 CG LYS A 68 8.460 3.226 11.511 1.00 54.11 C ATOM 1165 CD LYS A 68 9.775 4.035 11.439 1.00 64.20 C ATOM 1166 CE LYS A 68 10.541 4.060 12.770 1.00 21.24 C ATOM 1167 NZ LYS A 68 11.792 4.868 12.675 1.00 51.12 N ATOM 0 H LYS A 68 5.468 4.162 10.837 1.00 51.14 H new ATOM 0 HA LYS A 68 7.938 5.351 9.845 1.00 10.34 H new ATOM 0 HB2 LYS A 68 6.876 2.513 10.226 1.00 31.41 H new ATOM 0 HB3 LYS A 68 8.385 2.823 9.389 1.00 31.41 H new ATOM 0 HG2 LYS A 68 7.813 3.654 12.276 1.00 54.11 H new ATOM 0 HG3 LYS A 68 8.680 2.203 11.816 1.00 54.11 H new ATOM 0 HD2 LYS A 68 10.415 3.609 10.666 1.00 64.20 H new ATOM 0 HD3 LYS A 68 9.549 5.058 11.137 1.00 64.20 H new ATOM 0 HE2 LYS A 68 9.901 4.472 13.550 1.00 21.24 H new ATOM 0 HE3 LYS A 68 10.788 3.041 13.066 1.00 21.24 H new ATOM 0 HZ1 LYS A 68 12.281 4.861 13.593 1.00 51.12 H new ATOM 0 HZ2 LYS A 68 12.414 4.460 11.948 1.00 51.12 H new ATOM 0 HZ3 LYS A 68 11.554 5.847 12.417 1.00 51.12 H new ATOM 1181 N ILE A 69 5.576 4.792 7.818 1.00 35.41 N ATOM 1182 CA ILE A 69 5.159 4.920 6.411 1.00 2.22 C ATOM 1183 C ILE A 69 5.618 6.284 5.855 1.00 44.41 C ATOM 1184 O ILE A 69 5.402 7.330 6.483 1.00 32.11 O ATOM 1185 CB ILE A 69 3.604 4.758 6.232 1.00 41.24 C ATOM 1186 CG1 ILE A 69 3.133 3.359 6.743 1.00 53.13 C ATOM 1187 CG2 ILE A 69 3.189 4.969 4.755 1.00 43.15 C ATOM 1188 CD1 ILE A 69 1.630 3.102 6.664 1.00 11.21 C ATOM 0 H ILE A 69 4.810 4.881 8.485 1.00 35.41 H new ATOM 0 HA ILE A 69 5.633 4.113 5.852 1.00 2.22 H new ATOM 0 HB ILE A 69 3.115 5.525 6.832 1.00 41.24 H new ATOM 0 HG12 ILE A 69 3.646 2.589 6.167 1.00 53.13 H new ATOM 0 HG13 ILE A 69 3.449 3.245 7.780 1.00 53.13 H new ATOM 0 HG21 ILE A 69 2.110 4.851 4.660 1.00 43.15 H new ATOM 0 HG22 ILE A 69 3.474 5.972 4.437 1.00 43.15 H new ATOM 0 HG23 ILE A 69 3.691 4.233 4.127 1.00 43.15 H new ATOM 0 HD11 ILE A 69 1.411 2.104 7.043 1.00 11.21 H new ATOM 0 HD12 ILE A 69 1.102 3.842 7.265 1.00 11.21 H new ATOM 0 HD13 ILE A 69 1.302 3.176 5.627 1.00 11.21 H new ATOM 1200 N LYS A 70 6.266 6.238 4.685 1.00 71.43 N ATOM 1201 CA LYS A 70 6.811 7.412 3.988 1.00 13.05 C ATOM 1202 C LYS A 70 5.889 7.882 2.843 1.00 32.10 C ATOM 1203 O LYS A 70 5.990 9.030 2.411 1.00 32.34 O ATOM 1204 CB LYS A 70 8.214 7.067 3.429 1.00 75.30 C ATOM 1205 CG LYS A 70 9.239 6.664 4.506 1.00 41.10 C ATOM 1206 CD LYS A 70 10.642 6.411 3.924 1.00 13.42 C ATOM 1207 CE LYS A 70 11.684 6.108 5.010 1.00 11.12 C ATOM 1208 NZ LYS A 70 11.897 7.261 5.927 1.00 55.24 N ATOM 0 H LYS A 70 6.430 5.365 4.184 1.00 71.43 H new ATOM 0 HA LYS A 70 6.882 8.230 4.705 1.00 13.05 H new ATOM 0 HB2 LYS A 70 8.117 6.252 2.712 1.00 75.30 H new ATOM 0 HB3 LYS A 70 8.597 7.929 2.882 1.00 75.30 H new ATOM 0 HG2 LYS A 70 9.298 7.451 5.258 1.00 41.10 H new ATOM 0 HG3 LYS A 70 8.892 5.764 5.013 1.00 41.10 H new ATOM 0 HD2 LYS A 70 10.597 5.575 3.226 1.00 13.42 H new ATOM 0 HD3 LYS A 70 10.959 7.285 3.355 1.00 13.42 H new ATOM 0 HE2 LYS A 70 11.362 5.242 5.588 1.00 11.12 H new ATOM 0 HE3 LYS A 70 12.630 5.842 4.538 1.00 11.12 H new ATOM 0 HZ1 LYS A 70 12.633 7.021 6.622 1.00 55.24 H new ATOM 0 HZ2 LYS A 70 12.198 8.091 5.377 1.00 55.24 H new ATOM 0 HZ3 LYS A 70 11.010 7.478 6.424 1.00 55.24 H new ATOM 1222 N CYS A 71 5.007 6.989 2.354 1.00 10.01 N ATOM 1223 CA CYS A 71 4.124 7.280 1.201 1.00 22.15 C ATOM 1224 C CYS A 71 3.115 6.148 0.987 1.00 54.45 C ATOM 1225 O CYS A 71 3.461 4.974 1.118 1.00 15.44 O ATOM 1226 CB CYS A 71 4.956 7.478 -0.095 1.00 21.04 C ATOM 1227 SG CYS A 71 3.983 7.780 -1.584 1.00 41.41 S ATOM 0 H CYS A 71 4.885 6.053 2.741 1.00 10.01 H new ATOM 0 HA CYS A 71 3.585 8.201 1.424 1.00 22.15 H new ATOM 0 HB2 CYS A 71 5.637 8.316 0.052 1.00 21.04 H new ATOM 0 HB3 CYS A 71 5.571 6.592 -0.254 1.00 21.04 H new ATOM 0 HG CYS A 71 3.374 8.924 -1.480 1.00 41.41 H new ATOM 1233 N VAL A 72 1.857 6.514 0.677 1.00 43.11 N ATOM 1234 CA VAL A 72 0.820 5.574 0.202 1.00 55.33 C ATOM 1235 C VAL A 72 0.119 6.191 -1.015 1.00 21.15 C ATOM 1236 O VAL A 72 -0.452 7.276 -0.917 1.00 72.22 O ATOM 1237 CB VAL A 72 -0.267 5.216 1.292 1.00 43.43 C ATOM 1238 CG1 VAL A 72 -1.381 4.321 0.685 1.00 10.45 C ATOM 1239 CG2 VAL A 72 0.380 4.524 2.510 1.00 61.11 C ATOM 0 H VAL A 72 1.528 7.477 0.749 1.00 43.11 H new ATOM 0 HA VAL A 72 1.328 4.643 -0.048 1.00 55.33 H new ATOM 0 HB VAL A 72 -0.721 6.147 1.632 1.00 43.43 H new ATOM 0 HG11 VAL A 72 -2.118 4.087 1.453 1.00 10.45 H new ATOM 0 HG12 VAL A 72 -1.866 4.850 -0.135 1.00 10.45 H new ATOM 0 HG13 VAL A 72 -0.941 3.397 0.310 1.00 10.45 H new ATOM 0 HG21 VAL A 72 -0.389 4.288 3.245 1.00 61.11 H new ATOM 0 HG22 VAL A 72 0.869 3.604 2.189 1.00 61.11 H new ATOM 0 HG23 VAL A 72 1.118 5.190 2.957 1.00 61.11 H new ATOM 1249 N GLU A 73 0.165 5.485 -2.145 1.00 34.51 N ATOM 1250 CA GLU A 73 -0.493 5.894 -3.398 1.00 4.30 C ATOM 1251 C GLU A 73 -0.653 4.641 -4.275 1.00 2.44 C ATOM 1252 O GLU A 73 -0.095 3.590 -3.954 1.00 43.30 O ATOM 1253 CB GLU A 73 0.337 7.021 -4.119 1.00 53.22 C ATOM 1254 CG GLU A 73 -0.481 8.243 -4.607 1.00 34.11 C ATOM 1255 CD GLU A 73 -1.471 7.936 -5.745 1.00 15.20 C ATOM 1256 OE1 GLU A 73 -1.069 7.996 -6.930 1.00 52.04 O ATOM 1257 OE2 GLU A 73 -2.657 7.637 -5.458 1.00 74.44 O ATOM 0 H GLU A 73 0.666 4.600 -2.223 1.00 34.51 H new ATOM 0 HA GLU A 73 -1.476 6.320 -3.197 1.00 4.30 H new ATOM 0 HB2 GLU A 73 1.110 7.373 -3.435 1.00 53.22 H new ATOM 0 HB3 GLU A 73 0.846 6.581 -4.976 1.00 53.22 H new ATOM 0 HG2 GLU A 73 -1.034 8.654 -3.763 1.00 34.11 H new ATOM 0 HG3 GLU A 73 0.210 9.016 -4.943 1.00 34.11 H new ATOM 1264 N ILE A 74 -1.415 4.747 -5.367 1.00 2.03 N ATOM 1265 CA ILE A 74 -1.632 3.623 -6.293 1.00 22.05 C ATOM 1266 C ILE A 74 -0.395 3.362 -7.155 1.00 40.41 C ATOM 1267 O ILE A 74 0.503 4.209 -7.251 1.00 21.13 O ATOM 1268 CB ILE A 74 -2.923 3.842 -7.171 1.00 30.52 C ATOM 1269 CG1 ILE A 74 -2.865 5.131 -8.082 1.00 3.55 C ATOM 1270 CG2 ILE A 74 -4.138 3.906 -6.238 1.00 53.42 C ATOM 1271 CD1 ILE A 74 -2.268 4.938 -9.471 1.00 63.34 C ATOM 0 H ILE A 74 -1.897 5.605 -5.636 1.00 2.03 H new ATOM 0 HA ILE A 74 -1.799 2.729 -5.693 1.00 22.05 H new ATOM 0 HB ILE A 74 -2.997 3.001 -7.860 1.00 30.52 H new ATOM 0 HG12 ILE A 74 -3.877 5.519 -8.194 1.00 3.55 H new ATOM 0 HG13 ILE A 74 -2.286 5.894 -7.562 1.00 3.55 H new ATOM 0 HG21 ILE A 74 -5.042 4.057 -6.828 1.00 53.42 H new ATOM 0 HG22 ILE A 74 -4.220 2.972 -5.682 1.00 53.42 H new ATOM 0 HG23 ILE A 74 -4.017 4.734 -5.540 1.00 53.42 H new ATOM 0 HD11 ILE A 74 -2.279 5.887 -10.007 1.00 63.34 H new ATOM 0 HD12 ILE A 74 -1.241 4.585 -9.380 1.00 63.34 H new ATOM 0 HD13 ILE A 74 -2.857 4.204 -10.021 1.00 63.34 H new ATOM 1283 N VAL A 75 -0.366 2.178 -7.775 1.00 3.15 N ATOM 1284 CA VAL A 75 0.709 1.781 -8.690 1.00 34.40 C ATOM 1285 C VAL A 75 0.231 2.059 -10.126 1.00 12.21 C ATOM 1286 O VAL A 75 -0.626 1.329 -10.640 1.00 63.21 O ATOM 1287 CB VAL A 75 1.077 0.250 -8.529 1.00 1.12 C ATOM 1288 CG1 VAL A 75 2.246 -0.161 -9.459 1.00 41.30 C ATOM 1289 CG2 VAL A 75 1.389 -0.097 -7.056 1.00 33.42 C ATOM 0 H VAL A 75 -1.088 1.467 -7.656 1.00 3.15 H new ATOM 0 HA VAL A 75 1.608 2.353 -8.460 1.00 34.40 H new ATOM 0 HB VAL A 75 0.203 -0.326 -8.832 1.00 1.12 H new ATOM 0 HG11 VAL A 75 2.468 -1.219 -9.318 1.00 41.30 H new ATOM 0 HG12 VAL A 75 1.965 0.016 -10.497 1.00 41.30 H new ATOM 0 HG13 VAL A 75 3.129 0.430 -9.217 1.00 41.30 H new ATOM 0 HG21 VAL A 75 1.638 -1.155 -6.976 1.00 33.42 H new ATOM 0 HG22 VAL A 75 2.233 0.501 -6.712 1.00 33.42 H new ATOM 0 HG23 VAL A 75 0.516 0.118 -6.439 1.00 33.42 H new ATOM 1299 N LYS A 76 0.724 3.155 -10.742 1.00 24.04 N ATOM 1300 CA LYS A 76 0.487 3.408 -12.170 1.00 21.13 C ATOM 1301 C LYS A 76 1.361 2.415 -12.962 1.00 25.51 C ATOM 1302 O LYS A 76 2.579 2.575 -13.084 1.00 61.50 O ATOM 1303 CB LYS A 76 0.749 4.910 -12.547 1.00 33.30 C ATOM 1304 CG LYS A 76 2.164 5.441 -12.233 1.00 54.21 C ATOM 1305 CD LYS A 76 2.337 6.967 -12.460 1.00 33.12 C ATOM 1306 CE LYS A 76 2.171 7.401 -13.927 1.00 73.22 C ATOM 1307 NZ LYS A 76 2.445 8.860 -14.107 1.00 12.23 N ATOM 0 H LYS A 76 1.282 3.869 -10.274 1.00 24.04 H new ATOM 0 HA LYS A 76 -0.560 3.244 -12.425 1.00 21.13 H new ATOM 0 HB2 LYS A 76 0.562 5.036 -13.613 1.00 33.30 H new ATOM 0 HB3 LYS A 76 0.023 5.530 -12.021 1.00 33.30 H new ATOM 0 HG2 LYS A 76 2.404 5.210 -11.195 1.00 54.21 H new ATOM 0 HG3 LYS A 76 2.885 4.909 -12.853 1.00 54.21 H new ATOM 0 HD2 LYS A 76 1.609 7.500 -11.849 1.00 33.12 H new ATOM 0 HD3 LYS A 76 3.326 7.267 -12.112 1.00 33.12 H new ATOM 0 HE2 LYS A 76 2.848 6.823 -14.556 1.00 73.22 H new ATOM 0 HE3 LYS A 76 1.158 7.177 -14.260 1.00 73.22 H new ATOM 0 HZ1 LYS A 76 2.574 9.067 -15.118 1.00 12.23 H new ATOM 0 HZ2 LYS A 76 1.643 9.412 -13.741 1.00 12.23 H new ATOM 0 HZ3 LYS A 76 3.308 9.118 -13.588 1.00 12.23 H new ATOM 1382 N ILE A 82 -3.466 -6.961 -14.180 1.00 33.34 N ATOM 1383 CA ILE A 82 -2.931 -7.944 -13.225 1.00 74.02 C ATOM 1384 C ILE A 82 -3.718 -9.271 -13.336 1.00 53.13 C ATOM 1385 O ILE A 82 -4.939 -9.263 -13.145 1.00 34.41 O ATOM 1386 CB ILE A 82 -2.984 -7.390 -11.755 1.00 10.30 C ATOM 1387 CG1 ILE A 82 -2.223 -6.024 -11.636 1.00 43.14 C ATOM 1388 CG2 ILE A 82 -2.444 -8.421 -10.731 1.00 22.23 C ATOM 1389 CD1 ILE A 82 -0.745 -6.063 -12.027 1.00 21.32 C ATOM 0 HA ILE A 82 -1.886 -8.132 -13.472 1.00 74.02 H new ATOM 0 HB ILE A 82 -4.032 -7.213 -11.515 1.00 10.30 H new ATOM 0 HG12 ILE A 82 -2.728 -5.290 -12.263 1.00 43.14 H new ATOM 0 HG13 ILE A 82 -2.301 -5.672 -10.607 1.00 43.14 H new ATOM 0 HG21 ILE A 82 -2.498 -7.999 -9.727 1.00 22.23 H new ATOM 0 HG22 ILE A 82 -3.046 -9.328 -10.776 1.00 22.23 H new ATOM 0 HG23 ILE A 82 -1.408 -8.661 -10.969 1.00 22.23 H new ATOM 0 HD11 ILE A 82 -0.311 -5.070 -11.910 1.00 21.32 H new ATOM 0 HD12 ILE A 82 -0.217 -6.768 -11.385 1.00 21.32 H new ATOM 0 HD13 ILE A 82 -0.652 -6.379 -13.066 1.00 21.32 H new ATOM 1401 N PRO A 83 -3.033 -10.417 -13.695 1.00 11.14 N ATOM 1402 CA PRO A 83 -3.693 -11.727 -13.880 1.00 13.22 C ATOM 1403 C PRO A 83 -4.071 -12.340 -12.518 1.00 10.41 C ATOM 1404 O PRO A 83 -3.417 -13.261 -12.002 1.00 41.25 O ATOM 1405 CB PRO A 83 -2.629 -12.554 -14.645 1.00 62.04 C ATOM 1406 CG PRO A 83 -1.321 -12.004 -14.170 1.00 12.25 C ATOM 1407 CD PRO A 83 -1.559 -10.524 -13.927 1.00 10.00 C ATOM 0 HA PRO A 83 -4.635 -11.679 -14.427 1.00 13.22 H new ATOM 0 HB2 PRO A 83 -2.717 -13.618 -14.423 1.00 62.04 H new ATOM 0 HB3 PRO A 83 -2.739 -12.443 -15.724 1.00 62.04 H new ATOM 0 HG2 PRO A 83 -0.995 -12.503 -13.257 1.00 12.25 H new ATOM 0 HG3 PRO A 83 -0.539 -12.158 -14.914 1.00 12.25 H new ATOM 0 HD2 PRO A 83 -0.994 -10.167 -13.066 1.00 10.00 H new ATOM 0 HD3 PRO A 83 -1.247 -9.926 -14.783 1.00 10.00 H new ATOM 1415 N CYS A 84 -5.119 -11.769 -11.935 1.00 65.12 N ATOM 1416 CA CYS A 84 -5.574 -12.078 -10.581 1.00 72.13 C ATOM 1417 C CYS A 84 -6.998 -11.537 -10.355 1.00 74.10 C ATOM 1418 O CYS A 84 -7.483 -10.686 -11.119 1.00 63.44 O ATOM 1419 CB CYS A 84 -4.599 -11.457 -9.552 1.00 14.23 C ATOM 1420 SG CYS A 84 -5.038 -11.767 -7.839 1.00 63.51 S ATOM 0 H CYS A 84 -5.690 -11.063 -12.399 1.00 65.12 H new ATOM 0 HA CYS A 84 -5.593 -13.160 -10.452 1.00 72.13 H new ATOM 0 HB2 CYS A 84 -3.598 -11.848 -9.735 1.00 14.23 H new ATOM 0 HB3 CYS A 84 -4.555 -10.380 -9.715 1.00 14.23 H new ATOM 0 HG CYS A 84 -4.292 -11.040 -7.061 1.00 63.51 H new ATOM 1426 N GLN A 85 -7.651 -12.052 -9.298 1.00 61.04 N ATOM 1427 CA GLN A 85 -8.969 -11.574 -8.823 1.00 15.35 C ATOM 1428 C GLN A 85 -8.855 -10.135 -8.260 1.00 1.11 C ATOM 1429 O GLN A 85 -9.828 -9.370 -8.267 1.00 31.12 O ATOM 1430 CB GLN A 85 -9.520 -12.538 -7.739 1.00 32.14 C ATOM 1431 CG GLN A 85 -8.591 -12.685 -6.514 1.00 14.14 C ATOM 1432 CD GLN A 85 -9.194 -13.463 -5.354 1.00 34.24 C ATOM 1433 OE1 GLN A 85 -10.408 -13.489 -5.160 1.00 42.34 O ATOM 1434 NE2 GLN A 85 -8.345 -14.065 -4.548 1.00 4.21 N ATOM 0 H GLN A 85 -7.277 -12.820 -8.741 1.00 61.04 H new ATOM 0 HA GLN A 85 -9.661 -11.556 -9.665 1.00 15.35 H new ATOM 0 HB2 GLN A 85 -10.493 -12.178 -7.405 1.00 32.14 H new ATOM 0 HB3 GLN A 85 -9.679 -13.520 -8.184 1.00 32.14 H new ATOM 0 HG2 GLN A 85 -7.672 -13.180 -6.828 1.00 14.14 H new ATOM 0 HG3 GLN A 85 -8.314 -11.691 -6.163 1.00 14.14 H new ATOM 0 HE21 GLN A 85 -7.344 -14.023 -4.739 1.00 4.21 H new ATOM 0 HE22 GLN A 85 -8.688 -14.573 -3.733 1.00 4.21 H new ATOM 1443 N ASN A 86 -7.657 -9.808 -7.744 1.00 43.23 N ATOM 1444 CA ASN A 86 -7.279 -8.460 -7.297 1.00 34.22 C ATOM 1445 C ASN A 86 -6.392 -7.831 -8.384 1.00 42.04 C ATOM 1446 O ASN A 86 -5.208 -8.179 -8.513 1.00 51.44 O ATOM 1447 CB ASN A 86 -6.535 -8.508 -5.932 1.00 43.03 C ATOM 1448 CG ASN A 86 -7.399 -9.002 -4.759 1.00 52.13 C ATOM 1449 OD1 ASN A 86 -8.300 -9.813 -4.921 1.00 1.22 O ATOM 1450 ND2 ASN A 86 -7.130 -8.519 -3.557 1.00 63.44 N ATOM 0 H ASN A 86 -6.909 -10.491 -7.624 1.00 43.23 H new ATOM 0 HA ASN A 86 -8.174 -7.856 -7.147 1.00 34.22 H new ATOM 0 HB2 ASN A 86 -5.666 -9.159 -6.028 1.00 43.03 H new ATOM 0 HB3 ASN A 86 -6.162 -7.511 -5.699 1.00 43.03 H new ATOM 0 HD21 ASN A 86 -7.677 -8.823 -2.751 1.00 63.44 H new ATOM 0 HD22 ASN A 86 -6.376 -7.843 -3.436 1.00 63.44 H new ATOM 1457 N LYS A 87 -6.979 -6.915 -9.173 1.00 52.31 N ATOM 1458 CA LYS A 87 -6.360 -6.389 -10.411 1.00 54.24 C ATOM 1459 C LYS A 87 -6.014 -4.901 -10.313 1.00 62.02 C ATOM 1460 O LYS A 87 -5.490 -4.333 -11.286 1.00 2.43 O ATOM 1461 CB LYS A 87 -7.266 -6.657 -11.657 1.00 35.04 C ATOM 1462 CG LYS A 87 -8.765 -6.261 -11.515 1.00 13.30 C ATOM 1463 CD LYS A 87 -9.607 -7.375 -10.854 1.00 41.12 C ATOM 1464 CE LYS A 87 -11.102 -7.039 -10.756 1.00 1.34 C ATOM 1465 NZ LYS A 87 -11.873 -8.171 -10.172 1.00 42.40 N ATOM 0 H LYS A 87 -7.896 -6.516 -8.974 1.00 52.31 H new ATOM 0 HA LYS A 87 -5.422 -6.930 -10.537 1.00 54.24 H new ATOM 0 HB2 LYS A 87 -6.848 -6.117 -12.507 1.00 35.04 H new ATOM 0 HB3 LYS A 87 -7.213 -7.719 -11.897 1.00 35.04 H new ATOM 0 HG2 LYS A 87 -8.843 -5.350 -10.922 1.00 13.30 H new ATOM 0 HG3 LYS A 87 -9.174 -6.036 -12.500 1.00 13.30 H new ATOM 0 HD2 LYS A 87 -9.487 -8.296 -11.424 1.00 41.12 H new ATOM 0 HD3 LYS A 87 -9.220 -7.566 -9.853 1.00 41.12 H new ATOM 0 HE2 LYS A 87 -11.237 -6.149 -10.142 1.00 1.34 H new ATOM 0 HE3 LYS A 87 -11.490 -6.805 -11.747 1.00 1.34 H new ATOM 0 HZ1 LYS A 87 -12.725 -7.805 -9.702 1.00 42.40 H new ATOM 0 HZ2 LYS A 87 -12.151 -8.829 -10.928 1.00 42.40 H new ATOM 0 HZ3 LYS A 87 -11.282 -8.672 -9.477 1.00 42.40 H new ATOM 1479 N TYR A 88 -6.270 -4.262 -9.155 1.00 62.33 N ATOM 1480 CA TYR A 88 -5.940 -2.836 -8.973 1.00 45.23 C ATOM 1481 C TYR A 88 -4.981 -2.679 -7.774 1.00 52.14 C ATOM 1482 O TYR A 88 -5.430 -2.643 -6.623 1.00 43.21 O ATOM 1483 CB TYR A 88 -7.223 -1.974 -8.804 1.00 25.50 C ATOM 1484 CG TYR A 88 -7.006 -0.493 -9.169 1.00 23.24 C ATOM 1485 CD1 TYR A 88 -6.355 0.383 -8.298 1.00 44.22 C ATOM 1486 CD2 TYR A 88 -7.419 0.021 -10.402 1.00 44.43 C ATOM 1487 CE1 TYR A 88 -6.132 1.704 -8.634 1.00 34.55 C ATOM 1488 CE2 TYR A 88 -7.189 1.346 -10.742 1.00 71.44 C ATOM 1489 CZ TYR A 88 -6.548 2.180 -9.852 1.00 30.33 C ATOM 1490 OH TYR A 88 -6.317 3.497 -10.188 1.00 3.21 O ATOM 0 H TYR A 88 -6.699 -4.704 -8.342 1.00 62.33 H new ATOM 0 HA TYR A 88 -5.438 -2.471 -9.869 1.00 45.23 H new ATOM 0 HB2 TYR A 88 -8.015 -2.385 -9.430 1.00 25.50 H new ATOM 0 HB3 TYR A 88 -7.566 -2.042 -7.772 1.00 25.50 H new ATOM 0 HD1 TYR A 88 -6.018 0.019 -7.339 1.00 44.22 H new ATOM 0 HD2 TYR A 88 -7.926 -0.626 -11.103 1.00 44.43 H new ATOM 0 HE1 TYR A 88 -5.631 2.361 -7.939 1.00 34.55 H new ATOM 0 HE2 TYR A 88 -7.511 1.723 -11.701 1.00 71.44 H new ATOM 0 HH TYR A 88 -6.672 3.673 -11.084 1.00 3.21 H new ATOM 1500 N PRO A 89 -3.635 -2.616 -8.028 1.00 14.12 N ATOM 1501 CA PRO A 89 -2.635 -2.497 -6.957 1.00 14.35 C ATOM 1502 C PRO A 89 -2.451 -1.054 -6.442 1.00 35.01 C ATOM 1503 O PRO A 89 -2.487 -0.076 -7.208 1.00 50.55 O ATOM 1504 CB PRO A 89 -1.344 -3.013 -7.632 1.00 44.32 C ATOM 1505 CG PRO A 89 -1.493 -2.653 -9.083 1.00 22.34 C ATOM 1506 CD PRO A 89 -2.984 -2.679 -9.376 1.00 24.45 C ATOM 0 HA PRO A 89 -2.929 -3.054 -6.067 1.00 14.35 H new ATOM 0 HB2 PRO A 89 -0.459 -2.547 -7.199 1.00 44.32 H new ATOM 0 HB3 PRO A 89 -1.234 -4.090 -7.502 1.00 44.32 H new ATOM 0 HG2 PRO A 89 -1.074 -1.667 -9.284 1.00 22.34 H new ATOM 0 HG3 PRO A 89 -0.959 -3.362 -9.717 1.00 22.34 H new ATOM 0 HD2 PRO A 89 -3.280 -1.835 -9.999 1.00 24.45 H new ATOM 0 HD3 PRO A 89 -3.267 -3.585 -9.911 1.00 24.45 H new ATOM 1514 N PHE A 90 -2.272 -0.947 -5.128 1.00 20.31 N ATOM 1515 CA PHE A 90 -1.703 0.234 -4.479 1.00 2.50 C ATOM 1516 C PHE A 90 -0.442 -0.197 -3.727 1.00 71.21 C ATOM 1517 O PHE A 90 -0.178 -1.399 -3.568 1.00 32.21 O ATOM 1518 CB PHE A 90 -2.729 0.934 -3.544 1.00 51.50 C ATOM 1519 CG PHE A 90 -3.273 0.097 -2.372 1.00 23.35 C ATOM 1520 CD1 PHE A 90 -4.373 -0.754 -2.542 1.00 31.02 C ATOM 1521 CD2 PHE A 90 -2.706 0.178 -1.091 1.00 33.53 C ATOM 1522 CE1 PHE A 90 -4.880 -1.491 -1.481 1.00 25.13 C ATOM 1523 CE2 PHE A 90 -3.215 -0.562 -0.036 1.00 41.14 C ATOM 1524 CZ PHE A 90 -4.300 -1.393 -0.232 1.00 3.41 C ATOM 0 H PHE A 90 -2.521 -1.688 -4.473 1.00 20.31 H new ATOM 0 HA PHE A 90 -1.442 0.976 -5.233 1.00 2.50 H new ATOM 0 HB2 PHE A 90 -2.262 1.830 -3.135 1.00 51.50 H new ATOM 0 HB3 PHE A 90 -3.574 1.263 -4.150 1.00 51.50 H new ATOM 0 HD1 PHE A 90 -4.834 -0.838 -3.515 1.00 31.02 H new ATOM 0 HD2 PHE A 90 -1.859 0.828 -0.925 1.00 33.53 H new ATOM 0 HE1 PHE A 90 -5.729 -2.142 -1.632 1.00 25.13 H new ATOM 0 HE2 PHE A 90 -2.762 -0.489 0.942 1.00 41.14 H new ATOM 0 HZ PHE A 90 -4.696 -1.967 0.593 1.00 3.41 H new ATOM 1534 N GLN A 91 0.339 0.780 -3.275 1.00 52.44 N ATOM 1535 CA GLN A 91 1.621 0.528 -2.611 1.00 42.54 C ATOM 1536 C GLN A 91 1.762 1.382 -1.356 1.00 20.14 C ATOM 1537 O GLN A 91 1.153 2.455 -1.233 1.00 4.34 O ATOM 1538 CB GLN A 91 2.797 0.791 -3.586 1.00 72.11 C ATOM 1539 CG GLN A 91 2.855 2.208 -4.187 1.00 24.25 C ATOM 1540 CD GLN A 91 4.085 2.413 -5.065 1.00 42.23 C ATOM 1541 OE1 GLN A 91 4.057 2.138 -6.257 1.00 15.13 O ATOM 1542 NE2 GLN A 91 5.178 2.866 -4.468 1.00 44.32 N ATOM 0 H GLN A 91 0.104 1.769 -3.357 1.00 52.44 H new ATOM 0 HA GLN A 91 1.648 -0.519 -2.310 1.00 42.54 H new ATOM 0 HB2 GLN A 91 3.732 0.600 -3.060 1.00 72.11 H new ATOM 0 HB3 GLN A 91 2.737 0.071 -4.402 1.00 72.11 H new ATOM 0 HG2 GLN A 91 1.956 2.387 -4.777 1.00 24.25 H new ATOM 0 HG3 GLN A 91 2.860 2.942 -3.381 1.00 24.25 H new ATOM 0 HE21 GLN A 91 5.162 3.084 -3.472 1.00 44.32 H new ATOM 0 HE22 GLN A 91 6.035 2.996 -5.005 1.00 44.32 H new ATOM 1551 N VAL A 92 2.597 0.881 -0.438 1.00 52.41 N ATOM 1552 CA VAL A 92 2.908 1.528 0.830 1.00 72.35 C ATOM 1553 C VAL A 92 4.434 1.560 0.955 1.00 42.23 C ATOM 1554 O VAL A 92 5.047 0.538 1.273 1.00 54.22 O ATOM 1555 CB VAL A 92 2.272 0.747 2.059 1.00 74.22 C ATOM 1556 CG1 VAL A 92 2.660 1.400 3.410 1.00 33.41 C ATOM 1557 CG2 VAL A 92 0.732 0.637 1.915 1.00 55.52 C ATOM 0 H VAL A 92 3.084 -0.006 -0.565 1.00 52.41 H new ATOM 0 HA VAL A 92 2.487 2.533 0.847 1.00 72.35 H new ATOM 0 HB VAL A 92 2.683 -0.263 2.053 1.00 74.22 H new ATOM 0 HG11 VAL A 92 2.208 0.840 4.228 1.00 33.41 H new ATOM 0 HG12 VAL A 92 3.744 1.391 3.520 1.00 33.41 H new ATOM 0 HG13 VAL A 92 2.301 2.429 3.433 1.00 33.41 H new ATOM 0 HG21 VAL A 92 0.324 0.098 2.770 1.00 55.52 H new ATOM 0 HG22 VAL A 92 0.298 1.636 1.875 1.00 55.52 H new ATOM 0 HG23 VAL A 92 0.490 0.100 0.998 1.00 55.52 H new ATOM 1567 N VAL A 93 5.048 2.712 0.651 1.00 25.22 N ATOM 1568 CA VAL A 93 6.474 2.933 0.919 1.00 23.23 C ATOM 1569 C VAL A 93 6.628 3.200 2.419 1.00 74.42 C ATOM 1570 O VAL A 93 5.863 3.985 2.981 1.00 75.22 O ATOM 1571 CB VAL A 93 7.066 4.149 0.107 1.00 40.44 C ATOM 1572 CG1 VAL A 93 8.590 4.288 0.339 1.00 74.11 C ATOM 1573 CG2 VAL A 93 6.738 4.043 -1.403 1.00 53.10 C ATOM 0 H VAL A 93 4.577 3.506 0.218 1.00 25.22 H new ATOM 0 HA VAL A 93 7.026 2.048 0.605 1.00 23.23 H new ATOM 0 HB VAL A 93 6.586 5.053 0.481 1.00 40.44 H new ATOM 0 HG11 VAL A 93 8.969 5.134 -0.233 1.00 74.11 H new ATOM 0 HG12 VAL A 93 8.783 4.451 1.399 1.00 74.11 H new ATOM 0 HG13 VAL A 93 9.092 3.376 0.015 1.00 74.11 H new ATOM 0 HG21 VAL A 93 7.162 4.898 -1.928 1.00 53.10 H new ATOM 0 HG22 VAL A 93 7.164 3.123 -1.804 1.00 53.10 H new ATOM 0 HG23 VAL A 93 5.657 4.033 -1.541 1.00 53.10 H new ATOM 1583 N HIS A 94 7.588 2.531 3.053 1.00 62.22 N ATOM 1584 CA HIS A 94 7.826 2.641 4.497 1.00 42.24 C ATOM 1585 C HIS A 94 9.307 2.403 4.803 1.00 24.24 C ATOM 1586 O HIS A 94 10.091 2.120 3.899 1.00 21.33 O ATOM 1587 CB HIS A 94 6.918 1.655 5.284 1.00 34.22 C ATOM 1588 CG HIS A 94 7.123 0.195 4.958 1.00 62.35 C ATOM 1589 ND1 HIS A 94 7.789 -0.677 5.792 1.00 35.00 N ATOM 1590 CD2 HIS A 94 6.724 -0.547 3.893 1.00 71.41 C ATOM 1591 CE1 HIS A 94 7.793 -1.879 5.256 1.00 61.51 C ATOM 1592 NE2 HIS A 94 7.155 -1.831 4.106 1.00 3.34 N ATOM 0 H HIS A 94 8.228 1.893 2.580 1.00 62.22 H new ATOM 0 HA HIS A 94 7.568 3.649 4.821 1.00 42.24 H new ATOM 0 HB2 HIS A 94 7.089 1.800 6.351 1.00 34.22 H new ATOM 0 HB3 HIS A 94 5.876 1.912 5.091 1.00 34.22 H new ATOM 0 HD1 HIS A 94 8.213 -0.429 6.686 1.00 35.00 H new ATOM 0 HD2 HIS A 94 6.170 -0.192 3.037 1.00 71.41 H new ATOM 0 HE1 HIS A 94 8.245 -2.759 5.688 1.00 61.51 H new ATOM 0 HE2 HIS A 94 7.006 -2.620 3.476 1.00 3.34 H new ATOM 1601 N ASP A 95 9.633 2.483 6.099 1.00 53.14 N ATOM 1602 CA ASP A 95 10.999 2.407 6.666 1.00 34.01 C ATOM 1603 C ASP A 95 11.883 1.282 6.074 1.00 51.13 C ATOM 1604 O ASP A 95 13.082 1.486 5.868 1.00 44.04 O ATOM 1605 CB ASP A 95 10.888 2.222 8.206 1.00 11.43 C ATOM 1606 CG ASP A 95 10.194 0.897 8.605 1.00 14.34 C ATOM 1607 OD1 ASP A 95 9.002 0.717 8.256 1.00 23.21 O ATOM 1608 OD2 ASP A 95 10.844 0.017 9.217 1.00 40.42 O ATOM 0 H ASP A 95 8.923 2.608 6.821 1.00 53.14 H new ATOM 0 HA ASP A 95 11.496 3.340 6.401 1.00 34.01 H new ATOM 0 HB2 ASP A 95 11.886 2.249 8.643 1.00 11.43 H new ATOM 0 HB3 ASP A 95 10.332 3.059 8.628 1.00 11.43 H new ATOM 1613 N ALA A 96 11.291 0.101 5.816 1.00 42.14 N ATOM 1614 CA ALA A 96 12.034 -1.083 5.341 1.00 42.13 C ATOM 1615 C ALA A 96 12.134 -1.105 3.808 1.00 73.24 C ATOM 1616 O ALA A 96 13.240 -1.169 3.245 1.00 22.24 O ATOM 1617 CB ALA A 96 11.360 -2.357 5.874 1.00 25.31 C ATOM 0 H ALA A 96 10.290 -0.060 5.930 1.00 42.14 H new ATOM 0 HA ALA A 96 13.053 -1.035 5.724 1.00 42.13 H new ATOM 0 HB1 ALA A 96 11.908 -3.232 5.524 1.00 25.31 H new ATOM 0 HB2 ALA A 96 11.361 -2.340 6.964 1.00 25.31 H new ATOM 0 HB3 ALA A 96 10.333 -2.404 5.513 1.00 25.31 H new ATOM 1623 N ASN A 97 10.971 -1.029 3.139 1.00 10.14 N ATOM 1624 CA ASN A 97 10.886 -1.184 1.673 1.00 45.05 C ATOM 1625 C ASN A 97 9.598 -0.563 1.122 1.00 4.43 C ATOM 1626 O ASN A 97 8.854 0.099 1.845 1.00 42.23 O ATOM 1627 CB ASN A 97 10.986 -2.696 1.268 1.00 73.22 C ATOM 1628 CG ASN A 97 9.915 -3.617 1.900 1.00 3.22 C ATOM 1629 OD1 ASN A 97 8.789 -3.214 2.197 1.00 32.31 O ATOM 1630 ND2 ASN A 97 10.255 -4.875 2.089 1.00 13.33 N ATOM 0 H ASN A 97 10.072 -0.861 3.591 1.00 10.14 H new ATOM 0 HA ASN A 97 11.729 -0.652 1.233 1.00 45.05 H new ATOM 0 HB2 ASN A 97 10.913 -2.771 0.183 1.00 73.22 H new ATOM 0 HB3 ASN A 97 11.972 -3.067 1.548 1.00 73.22 H new ATOM 0 HD21 ASN A 97 9.582 -5.531 2.486 1.00 13.33 H new ATOM 0 HD22 ASN A 97 11.191 -5.194 1.838 1.00 13.33 H new ATOM 1637 N THR A 98 9.368 -0.766 -0.181 1.00 11.44 N ATOM 1638 CA THR A 98 8.110 -0.423 -0.845 1.00 65.40 C ATOM 1639 C THR A 98 7.247 -1.700 -0.977 1.00 73.33 C ATOM 1640 O THR A 98 7.594 -2.622 -1.729 1.00 23.42 O ATOM 1641 CB THR A 98 8.386 0.210 -2.250 1.00 50.15 C ATOM 1642 OG1 THR A 98 9.269 1.335 -2.094 1.00 63.45 O ATOM 1643 CG2 THR A 98 7.092 0.674 -2.945 1.00 72.52 C ATOM 0 H THR A 98 10.059 -1.178 -0.808 1.00 11.44 H new ATOM 0 HA THR A 98 7.572 0.315 -0.250 1.00 65.40 H new ATOM 0 HB THR A 98 8.841 -0.557 -2.877 1.00 50.15 H new ATOM 0 HG1 THR A 98 9.447 1.735 -2.971 1.00 63.45 H new ATOM 0 HG21 THR A 98 7.335 1.106 -3.916 1.00 72.52 H new ATOM 0 HG22 THR A 98 6.427 -0.179 -3.083 1.00 72.52 H new ATOM 0 HG23 THR A 98 6.596 1.424 -2.328 1.00 72.52 H new ATOM 1651 N LEU A 99 6.157 -1.768 -0.195 1.00 3.11 N ATOM 1652 CA LEU A 99 5.227 -2.916 -0.200 1.00 63.22 C ATOM 1653 C LEU A 99 4.167 -2.731 -1.305 1.00 41.54 C ATOM 1654 O LEU A 99 3.813 -1.603 -1.626 1.00 3.13 O ATOM 1655 CB LEU A 99 4.540 -3.064 1.186 1.00 13.24 C ATOM 1656 CG LEU A 99 3.710 -4.377 1.385 1.00 51.00 C ATOM 1657 CD1 LEU A 99 4.618 -5.628 1.320 1.00 65.10 C ATOM 1658 CD2 LEU A 99 2.888 -4.344 2.694 1.00 61.41 C ATOM 0 H LEU A 99 5.893 -1.031 0.459 1.00 3.11 H new ATOM 0 HA LEU A 99 5.794 -3.825 -0.403 1.00 63.22 H new ATOM 0 HB2 LEU A 99 5.306 -3.017 1.960 1.00 13.24 H new ATOM 0 HB3 LEU A 99 3.880 -2.210 1.339 1.00 13.24 H new ATOM 0 HG LEU A 99 2.999 -4.439 0.561 1.00 51.00 H new ATOM 0 HD11 LEU A 99 4.014 -6.524 1.462 1.00 65.10 H new ATOM 0 HD12 LEU A 99 5.109 -5.671 0.348 1.00 65.10 H new ATOM 0 HD13 LEU A 99 5.372 -5.571 2.105 1.00 65.10 H new ATOM 0 HD21 LEU A 99 2.327 -5.273 2.795 1.00 61.41 H new ATOM 0 HD22 LEU A 99 3.561 -4.233 3.544 1.00 61.41 H new ATOM 0 HD23 LEU A 99 2.196 -3.503 2.668 1.00 61.41 H new ATOM 1670 N TYR A 100 3.669 -3.844 -1.880 1.00 64.41 N ATOM 1671 CA TYR A 100 2.659 -3.820 -2.963 1.00 13.42 C ATOM 1672 C TYR A 100 1.449 -4.662 -2.561 1.00 62.32 C ATOM 1673 O TYR A 100 1.527 -5.899 -2.522 1.00 24.41 O ATOM 1674 CB TYR A 100 3.276 -4.330 -4.292 1.00 63.44 C ATOM 1675 CG TYR A 100 4.380 -3.400 -4.797 1.00 22.44 C ATOM 1676 CD1 TYR A 100 4.065 -2.246 -5.513 1.00 14.34 C ATOM 1677 CD2 TYR A 100 5.725 -3.640 -4.503 1.00 65.51 C ATOM 1678 CE1 TYR A 100 5.046 -1.367 -5.914 1.00 40.42 C ATOM 1679 CE2 TYR A 100 6.706 -2.766 -4.913 1.00 44.21 C ATOM 1680 CZ TYR A 100 6.360 -1.636 -5.612 1.00 20.52 C ATOM 1681 OH TYR A 100 7.341 -0.754 -5.989 1.00 53.32 O ATOM 0 H TYR A 100 3.954 -4.785 -1.609 1.00 64.41 H new ATOM 0 HA TYR A 100 2.329 -2.793 -3.121 1.00 13.42 H new ATOM 0 HB2 TYR A 100 3.682 -5.331 -4.144 1.00 63.44 H new ATOM 0 HB3 TYR A 100 2.495 -4.412 -5.048 1.00 63.44 H new ATOM 0 HD1 TYR A 100 3.034 -2.038 -5.757 1.00 14.34 H new ATOM 0 HD2 TYR A 100 5.999 -4.524 -3.946 1.00 65.51 H new ATOM 0 HE1 TYR A 100 4.785 -0.473 -6.461 1.00 40.42 H new ATOM 0 HE2 TYR A 100 7.742 -2.968 -4.686 1.00 44.21 H new ATOM 0 HH TYR A 100 7.014 -0.196 -6.725 1.00 53.32 H new ATOM 1691 N ILE A 101 0.347 -3.968 -2.243 1.00 25.31 N ATOM 1692 CA ILE A 101 -0.914 -4.587 -1.828 1.00 45.42 C ATOM 1693 C ILE A 101 -1.954 -4.420 -2.961 1.00 4.14 C ATOM 1694 O ILE A 101 -2.372 -3.304 -3.259 1.00 34.21 O ATOM 1695 CB ILE A 101 -1.472 -3.929 -0.508 1.00 31.21 C ATOM 1696 CG1 ILE A 101 -0.363 -3.808 0.586 1.00 43.13 C ATOM 1697 CG2 ILE A 101 -2.681 -4.739 0.023 1.00 42.11 C ATOM 1698 CD1 ILE A 101 -0.773 -3.017 1.820 1.00 4.42 C ATOM 0 H ILE A 101 0.309 -2.949 -2.268 1.00 25.31 H new ATOM 0 HA ILE A 101 -0.730 -5.643 -1.629 1.00 45.42 H new ATOM 0 HB ILE A 101 -1.804 -2.919 -0.749 1.00 31.21 H new ATOM 0 HG12 ILE A 101 -0.066 -4.810 0.895 1.00 43.13 H new ATOM 0 HG13 ILE A 101 0.515 -3.337 0.144 1.00 43.13 H new ATOM 0 HG21 ILE A 101 -3.058 -4.275 0.935 1.00 42.11 H new ATOM 0 HG22 ILE A 101 -3.469 -4.752 -0.730 1.00 42.11 H new ATOM 0 HG23 ILE A 101 -2.368 -5.761 0.238 1.00 42.11 H new ATOM 0 HD11 ILE A 101 0.058 -2.985 2.525 1.00 4.42 H new ATOM 0 HD12 ILE A 101 -1.041 -2.001 1.529 1.00 4.42 H new ATOM 0 HD13 ILE A 101 -1.630 -3.497 2.292 1.00 4.42 H new ATOM 1710 N PHE A 102 -2.341 -5.533 -3.582 1.00 53.14 N ATOM 1711 CA PHE A 102 -3.348 -5.577 -4.652 1.00 54.54 C ATOM 1712 C PHE A 102 -4.753 -5.594 -4.031 1.00 65.23 C ATOM 1713 O PHE A 102 -5.050 -6.438 -3.180 1.00 2.12 O ATOM 1714 CB PHE A 102 -3.110 -6.841 -5.526 1.00 50.53 C ATOM 1715 CG PHE A 102 -1.732 -6.867 -6.210 1.00 20.12 C ATOM 1716 CD1 PHE A 102 -0.564 -7.113 -5.474 1.00 73.31 C ATOM 1717 CD2 PHE A 102 -1.598 -6.609 -7.572 1.00 21.21 C ATOM 1718 CE1 PHE A 102 0.678 -7.099 -6.082 1.00 62.14 C ATOM 1719 CE2 PHE A 102 -0.350 -6.590 -8.175 1.00 2.13 C ATOM 1720 CZ PHE A 102 0.785 -6.835 -7.430 1.00 0.11 C ATOM 0 H PHE A 102 -1.958 -6.450 -3.354 1.00 53.14 H new ATOM 0 HA PHE A 102 -3.263 -4.694 -5.286 1.00 54.54 H new ATOM 0 HB2 PHE A 102 -3.213 -7.729 -4.902 1.00 50.53 H new ATOM 0 HB3 PHE A 102 -3.886 -6.896 -6.289 1.00 50.53 H new ATOM 0 HD1 PHE A 102 -0.636 -7.317 -4.416 1.00 73.31 H new ATOM 0 HD2 PHE A 102 -2.479 -6.421 -8.167 1.00 21.21 H new ATOM 0 HE1 PHE A 102 1.566 -7.295 -5.499 1.00 62.14 H new ATOM 0 HE2 PHE A 102 -0.266 -6.383 -9.232 1.00 2.13 H new ATOM 0 HZ PHE A 102 1.756 -6.820 -7.903 1.00 0.11 H new ATOM 1730 N ALA A 103 -5.593 -4.639 -4.439 1.00 23.13 N ATOM 1731 CA ALA A 103 -6.991 -4.542 -3.995 1.00 11.12 C ATOM 1732 C ALA A 103 -7.916 -5.254 -5.005 1.00 64.32 C ATOM 1733 O ALA A 103 -7.622 -5.239 -6.212 1.00 70.34 O ATOM 1734 CB ALA A 103 -7.386 -3.069 -3.840 1.00 33.10 C ATOM 0 H ALA A 103 -5.322 -3.904 -5.092 1.00 23.13 H new ATOM 0 HA ALA A 103 -7.097 -5.033 -3.027 1.00 11.12 H new ATOM 0 HB1 ALA A 103 -8.423 -3.003 -3.511 1.00 33.10 H new ATOM 0 HB2 ALA A 103 -6.740 -2.595 -3.101 1.00 33.10 H new ATOM 0 HB3 ALA A 103 -7.276 -2.560 -4.798 1.00 33.10 H new ATOM 1740 N PRO A 104 -9.048 -5.898 -4.526 1.00 43.03 N ATOM 1741 CA PRO A 104 -10.039 -6.592 -5.406 1.00 10.44 C ATOM 1742 C PRO A 104 -10.530 -5.725 -6.581 1.00 72.41 C ATOM 1743 O PRO A 104 -10.696 -6.204 -7.707 1.00 50.42 O ATOM 1744 CB PRO A 104 -11.199 -6.920 -4.431 1.00 22.21 C ATOM 1745 CG PRO A 104 -10.542 -7.054 -3.088 1.00 31.32 C ATOM 1746 CD PRO A 104 -9.428 -6.033 -3.085 1.00 64.14 C ATOM 0 HA PRO A 104 -9.606 -7.466 -5.893 1.00 10.44 H new ATOM 0 HB2 PRO A 104 -11.949 -6.129 -4.428 1.00 22.21 H new ATOM 0 HB3 PRO A 104 -11.708 -7.841 -4.716 1.00 22.21 H new ATOM 0 HG2 PRO A 104 -11.251 -6.864 -2.282 1.00 31.32 H new ATOM 0 HG3 PRO A 104 -10.153 -8.061 -2.939 1.00 31.32 H new ATOM 0 HD2 PRO A 104 -9.761 -5.082 -2.670 1.00 64.14 H new ATOM 0 HD3 PRO A 104 -8.584 -6.366 -2.480 1.00 64.14 H new ATOM 1754 N SER A 105 -10.707 -4.433 -6.293 1.00 41.04 N ATOM 1755 CA SER A 105 -11.212 -3.444 -7.246 1.00 12.42 C ATOM 1756 C SER A 105 -10.633 -2.058 -6.906 1.00 30.12 C ATOM 1757 O SER A 105 -10.057 -1.880 -5.820 1.00 21.54 O ATOM 1758 CB SER A 105 -12.757 -3.424 -7.159 1.00 1.04 C ATOM 1759 OG SER A 105 -13.188 -3.083 -5.846 1.00 73.15 O ATOM 0 H SER A 105 -10.500 -4.039 -5.375 1.00 41.04 H new ATOM 0 HA SER A 105 -10.909 -3.703 -8.260 1.00 12.42 H new ATOM 0 HB2 SER A 105 -13.156 -2.706 -7.875 1.00 1.04 H new ATOM 0 HB3 SER A 105 -13.153 -4.402 -7.434 1.00 1.04 H new ATOM 0 HG SER A 105 -14.114 -3.377 -5.719 1.00 73.15 H new ATOM 1765 N PRO A 106 -10.785 -1.031 -7.817 1.00 15.31 N ATOM 1766 CA PRO A 106 -10.553 0.395 -7.457 1.00 34.10 C ATOM 1767 C PRO A 106 -11.508 0.908 -6.344 1.00 2.43 C ATOM 1768 O PRO A 106 -11.246 1.954 -5.749 1.00 35.44 O ATOM 1769 CB PRO A 106 -10.766 1.149 -8.796 1.00 14.01 C ATOM 1770 CG PRO A 106 -11.550 0.211 -9.663 1.00 45.01 C ATOM 1771 CD PRO A 106 -11.106 -1.174 -9.270 1.00 2.25 C ATOM 0 HA PRO A 106 -9.561 0.550 -7.032 1.00 34.10 H new ATOM 0 HB2 PRO A 106 -11.306 2.083 -8.639 1.00 14.01 H new ATOM 0 HB3 PRO A 106 -9.813 1.406 -9.258 1.00 14.01 H new ATOM 0 HG2 PRO A 106 -12.621 0.337 -9.508 1.00 45.01 H new ATOM 0 HG3 PRO A 106 -11.356 0.399 -10.719 1.00 45.01 H new ATOM 0 HD2 PRO A 106 -11.891 -1.911 -9.438 1.00 2.25 H new ATOM 0 HD3 PRO A 106 -10.238 -1.496 -9.844 1.00 2.25 H new ATOM 1779 N GLN A 107 -12.569 0.132 -6.044 1.00 21.30 N ATOM 1780 CA GLN A 107 -13.563 0.472 -5.007 1.00 72.52 C ATOM 1781 C GLN A 107 -12.949 0.218 -3.620 1.00 52.51 C ATOM 1782 O GLN A 107 -12.883 1.124 -2.779 1.00 33.35 O ATOM 1783 CB GLN A 107 -14.856 -0.376 -5.191 1.00 54.14 C ATOM 1784 CG GLN A 107 -15.458 -0.360 -6.614 1.00 42.40 C ATOM 1785 CD GLN A 107 -15.896 1.027 -7.096 1.00 22.02 C ATOM 1786 OE1 GLN A 107 -16.302 1.878 -6.305 1.00 32.54 O ATOM 1787 NE2 GLN A 107 -15.844 1.258 -8.402 1.00 53.44 N ATOM 0 H GLN A 107 -12.761 -0.751 -6.516 1.00 21.30 H new ATOM 0 HA GLN A 107 -13.834 1.524 -5.098 1.00 72.52 H new ATOM 0 HB2 GLN A 107 -14.636 -1.408 -4.919 1.00 54.14 H new ATOM 0 HB3 GLN A 107 -15.610 -0.016 -4.491 1.00 54.14 H new ATOM 0 HG2 GLN A 107 -14.722 -0.759 -7.312 1.00 42.40 H new ATOM 0 HG3 GLN A 107 -16.318 -1.029 -6.640 1.00 42.40 H new ATOM 0 HE21 GLN A 107 -15.503 0.534 -9.035 1.00 53.44 H new ATOM 0 HE22 GLN A 107 -16.145 2.159 -8.773 1.00 53.44 H new ATOM 1796 N SER A 108 -12.494 -1.037 -3.412 1.00 23.12 N ATOM 1797 CA SER A 108 -11.766 -1.459 -2.200 1.00 44.23 C ATOM 1798 C SER A 108 -10.503 -0.598 -1.987 1.00 14.33 C ATOM 1799 O SER A 108 -10.227 -0.131 -0.871 1.00 4.05 O ATOM 1800 CB SER A 108 -11.382 -2.943 -2.337 1.00 54.54 C ATOM 1801 OG SER A 108 -12.489 -3.705 -2.790 1.00 50.22 O ATOM 0 H SER A 108 -12.624 -1.790 -4.088 1.00 23.12 H new ATOM 0 HA SER A 108 -12.411 -1.324 -1.332 1.00 44.23 H new ATOM 0 HB2 SER A 108 -10.552 -3.046 -3.036 1.00 54.54 H new ATOM 0 HB3 SER A 108 -11.039 -3.326 -1.376 1.00 54.54 H new ATOM 0 HG SER A 108 -12.227 -4.646 -2.873 1.00 50.22 H new ATOM 1807 N ARG A 109 -9.777 -0.385 -3.104 1.00 51.12 N ATOM 1808 CA ARG A 109 -8.584 0.487 -3.173 1.00 74.23 C ATOM 1809 C ARG A 109 -8.881 1.868 -2.582 1.00 33.45 C ATOM 1810 O ARG A 109 -8.103 2.377 -1.778 1.00 5.50 O ATOM 1811 CB ARG A 109 -8.135 0.606 -4.666 1.00 72.20 C ATOM 1812 CG ARG A 109 -6.971 1.582 -5.019 1.00 44.21 C ATOM 1813 CD ARG A 109 -7.363 3.087 -5.105 1.00 43.10 C ATOM 1814 NE ARG A 109 -8.630 3.334 -5.812 1.00 62.23 N ATOM 1815 CZ ARG A 109 -9.166 4.556 -6.025 1.00 2.53 C ATOM 1816 NH1 ARG A 109 -8.561 5.668 -5.606 1.00 3.45 N ATOM 1817 NH2 ARG A 109 -10.363 4.657 -6.577 1.00 65.32 N ATOM 0 H ARG A 109 -10.006 -0.820 -3.998 1.00 51.12 H new ATOM 0 HA ARG A 109 -7.779 0.048 -2.583 1.00 74.23 H new ATOM 0 HB2 ARG A 109 -7.847 -0.389 -5.006 1.00 72.20 H new ATOM 0 HB3 ARG A 109 -9.005 0.903 -5.251 1.00 72.20 H new ATOM 0 HG2 ARG A 109 -6.187 1.471 -4.270 1.00 44.21 H new ATOM 0 HG3 ARG A 109 -6.544 1.280 -5.975 1.00 44.21 H new ATOM 0 HD2 ARG A 109 -7.437 3.491 -4.095 1.00 43.10 H new ATOM 0 HD3 ARG A 109 -6.565 3.632 -5.609 1.00 43.10 H new ATOM 0 HE ARG A 109 -9.140 2.525 -6.167 1.00 62.23 H new ATOM 0 HH11 ARG A 109 -7.671 5.609 -5.111 1.00 3.45 H new ATOM 0 HH12 ARG A 109 -8.988 6.578 -5.780 1.00 3.45 H new ATOM 0 HH21 ARG A 109 -10.876 3.816 -6.839 1.00 65.32 H new ATOM 0 HH22 ARG A 109 -10.773 5.576 -6.740 1.00 65.32 H new ATOM 1831 N ASP A 110 -10.013 2.456 -3.022 1.00 72.12 N ATOM 1832 CA ASP A 110 -10.368 3.854 -2.735 1.00 70.25 C ATOM 1833 C ASP A 110 -10.416 4.122 -1.235 1.00 4.40 C ATOM 1834 O ASP A 110 -9.884 5.130 -0.764 1.00 2.00 O ATOM 1835 CB ASP A 110 -11.723 4.215 -3.393 1.00 21.51 C ATOM 1836 CG ASP A 110 -12.058 5.708 -3.267 1.00 73.12 C ATOM 1837 OD1 ASP A 110 -11.349 6.523 -3.903 1.00 32.31 O ATOM 1838 OD2 ASP A 110 -13.003 6.081 -2.532 1.00 74.23 O ATOM 0 H ASP A 110 -10.707 1.969 -3.589 1.00 72.12 H new ATOM 0 HA ASP A 110 -9.590 4.488 -3.161 1.00 70.25 H new ATOM 0 HB2 ASP A 110 -11.696 3.940 -4.447 1.00 21.51 H new ATOM 0 HB3 ASP A 110 -12.516 3.628 -2.930 1.00 21.51 H new ATOM 1843 N LEU A 111 -11.015 3.176 -0.502 1.00 12.24 N ATOM 1844 CA LEU A 111 -11.149 3.263 0.950 1.00 33.42 C ATOM 1845 C LEU A 111 -9.786 3.047 1.637 1.00 2.13 C ATOM 1846 O LEU A 111 -9.412 3.840 2.497 1.00 21.54 O ATOM 1847 CB LEU A 111 -12.213 2.249 1.453 1.00 5.25 C ATOM 1848 CG LEU A 111 -12.650 2.385 2.951 1.00 30.53 C ATOM 1849 CD1 LEU A 111 -13.180 3.804 3.271 1.00 31.54 C ATOM 1850 CD2 LEU A 111 -13.698 1.301 3.316 1.00 2.43 C ATOM 0 H LEU A 111 -11.419 2.330 -0.903 1.00 12.24 H new ATOM 0 HA LEU A 111 -11.491 4.264 1.214 1.00 33.42 H new ATOM 0 HB2 LEU A 111 -13.101 2.347 0.828 1.00 5.25 H new ATOM 0 HB3 LEU A 111 -11.825 1.242 1.300 1.00 5.25 H new ATOM 0 HG LEU A 111 -11.765 2.228 3.567 1.00 30.53 H new ATOM 0 HD11 LEU A 111 -13.472 3.855 4.320 1.00 31.54 H new ATOM 0 HD12 LEU A 111 -12.397 4.537 3.076 1.00 31.54 H new ATOM 0 HD13 LEU A 111 -14.044 4.020 2.643 1.00 31.54 H new ATOM 0 HD21 LEU A 111 -13.988 1.413 4.361 1.00 2.43 H new ATOM 0 HD22 LEU A 111 -14.576 1.416 2.681 1.00 2.43 H new ATOM 0 HD23 LEU A 111 -13.267 0.312 3.163 1.00 2.43 H new ATOM 1862 N TRP A 112 -9.039 1.997 1.228 1.00 33.43 N ATOM 1863 CA TRP A 112 -7.724 1.659 1.839 1.00 34.21 C ATOM 1864 C TRP A 112 -6.684 2.797 1.706 1.00 23.43 C ATOM 1865 O TRP A 112 -6.125 3.237 2.715 1.00 40.32 O ATOM 1866 CB TRP A 112 -7.161 0.332 1.248 1.00 74.42 C ATOM 1867 CG TRP A 112 -7.731 -0.910 1.898 1.00 2.30 C ATOM 1868 CD1 TRP A 112 -8.750 -1.697 1.446 1.00 53.35 C ATOM 1869 CD2 TRP A 112 -7.301 -1.492 3.143 1.00 64.24 C ATOM 1870 NE1 TRP A 112 -8.997 -2.710 2.336 1.00 32.40 N ATOM 1871 CE2 TRP A 112 -8.117 -2.612 3.383 1.00 44.32 C ATOM 1872 CE3 TRP A 112 -6.308 -1.170 4.077 1.00 40.23 C ATOM 1873 CZ2 TRP A 112 -7.973 -3.408 4.516 1.00 62.33 C ATOM 1874 CZ3 TRP A 112 -6.167 -1.965 5.199 1.00 41.24 C ATOM 1875 CH2 TRP A 112 -6.995 -3.074 5.409 1.00 45.34 C ATOM 0 H TRP A 112 -9.320 1.366 0.478 1.00 33.43 H new ATOM 0 HA TRP A 112 -7.907 1.524 2.905 1.00 34.21 H new ATOM 0 HB2 TRP A 112 -7.372 0.302 0.179 1.00 74.42 H new ATOM 0 HB3 TRP A 112 -6.077 0.325 1.360 1.00 74.42 H new ATOM 0 HD1 TRP A 112 -9.285 -1.544 0.520 1.00 53.35 H new ATOM 0 HE1 TRP A 112 -9.720 -3.423 2.235 1.00 32.40 H new ATOM 0 HE3 TRP A 112 -5.664 -0.316 3.923 1.00 40.23 H new ATOM 0 HZ2 TRP A 112 -8.613 -4.261 4.683 1.00 62.33 H new ATOM 0 HZ3 TRP A 112 -5.405 -1.726 5.926 1.00 41.24 H new ATOM 0 HH2 TRP A 112 -6.858 -3.677 6.294 1.00 45.34 H new ATOM 1886 N VAL A 113 -6.439 3.268 0.467 1.00 41.12 N ATOM 1887 CA VAL A 113 -5.439 4.326 0.187 1.00 22.11 C ATOM 1888 C VAL A 113 -5.808 5.632 0.920 1.00 2.42 C ATOM 1889 O VAL A 113 -4.935 6.305 1.468 1.00 65.13 O ATOM 1890 CB VAL A 113 -5.301 4.607 -1.357 1.00 22.23 C ATOM 1891 CG1 VAL A 113 -4.213 5.667 -1.665 1.00 52.02 C ATOM 1892 CG2 VAL A 113 -5.020 3.309 -2.132 1.00 4.13 C ATOM 0 H VAL A 113 -6.923 2.931 -0.365 1.00 41.12 H new ATOM 0 HA VAL A 113 -4.479 3.964 0.554 1.00 22.11 H new ATOM 0 HB VAL A 113 -6.256 5.013 -1.689 1.00 22.23 H new ATOM 0 HG11 VAL A 113 -4.155 5.827 -2.742 1.00 52.02 H new ATOM 0 HG12 VAL A 113 -4.469 6.605 -1.172 1.00 52.02 H new ATOM 0 HG13 VAL A 113 -3.249 5.316 -1.298 1.00 52.02 H new ATOM 0 HG21 VAL A 113 -4.929 3.532 -3.195 1.00 4.13 H new ATOM 0 HG22 VAL A 113 -4.091 2.865 -1.774 1.00 4.13 H new ATOM 0 HG23 VAL A 113 -5.840 2.608 -1.977 1.00 4.13 H new ATOM 1902 N LYS A 114 -7.120 5.945 0.940 1.00 24.50 N ATOM 1903 CA LYS A 114 -7.664 7.132 1.627 1.00 75.43 C ATOM 1904 C LYS A 114 -7.359 7.091 3.130 1.00 74.42 C ATOM 1905 O LYS A 114 -6.800 8.043 3.670 1.00 23.41 O ATOM 1906 CB LYS A 114 -9.192 7.222 1.386 1.00 72.33 C ATOM 1907 CG LYS A 114 -9.901 8.431 2.038 1.00 62.00 C ATOM 1908 CD LYS A 114 -11.402 8.491 1.667 1.00 60.30 C ATOM 1909 CE LYS A 114 -12.122 9.698 2.286 1.00 64.35 C ATOM 1910 NZ LYS A 114 -13.540 9.797 1.835 1.00 0.13 N ATOM 0 H LYS A 114 -7.833 5.380 0.479 1.00 24.50 H new ATOM 0 HA LYS A 114 -7.183 8.020 1.215 1.00 75.43 H new ATOM 0 HB2 LYS A 114 -9.371 7.255 0.311 1.00 72.33 H new ATOM 0 HB3 LYS A 114 -9.655 6.308 1.758 1.00 72.33 H new ATOM 0 HG2 LYS A 114 -9.797 8.371 3.121 1.00 62.00 H new ATOM 0 HG3 LYS A 114 -9.412 9.352 1.721 1.00 62.00 H new ATOM 0 HD2 LYS A 114 -11.502 8.532 0.582 1.00 60.30 H new ATOM 0 HD3 LYS A 114 -11.890 7.574 1.998 1.00 60.30 H new ATOM 0 HE2 LYS A 114 -12.092 9.619 3.373 1.00 64.35 H new ATOM 0 HE3 LYS A 114 -11.592 10.612 2.018 1.00 64.35 H new ATOM 0 HZ1 LYS A 114 -13.988 10.625 2.277 1.00 0.13 H new ATOM 0 HZ2 LYS A 114 -13.569 9.898 0.800 1.00 0.13 H new ATOM 0 HZ3 LYS A 114 -14.054 8.936 2.113 1.00 0.13 H new ATOM 1924 N LYS A 115 -7.702 5.958 3.776 1.00 14.44 N ATOM 1925 CA LYS A 115 -7.493 5.755 5.224 1.00 43.15 C ATOM 1926 C LYS A 115 -6.015 5.898 5.611 1.00 22.21 C ATOM 1927 O LYS A 115 -5.686 6.599 6.575 1.00 2.54 O ATOM 1928 CB LYS A 115 -8.032 4.363 5.666 1.00 74.32 C ATOM 1929 CG LYS A 115 -9.568 4.236 5.613 1.00 53.12 C ATOM 1930 CD LYS A 115 -10.267 5.264 6.531 1.00 14.12 C ATOM 1931 CE LYS A 115 -11.794 5.248 6.407 1.00 71.12 C ATOM 1932 NZ LYS A 115 -12.430 6.186 7.376 1.00 5.41 N ATOM 0 H LYS A 115 -8.131 5.159 3.309 1.00 14.44 H new ATOM 0 HA LYS A 115 -8.051 6.533 5.745 1.00 43.15 H new ATOM 0 HB2 LYS A 115 -7.593 3.596 5.028 1.00 74.32 H new ATOM 0 HB3 LYS A 115 -7.697 4.162 6.683 1.00 74.32 H new ATOM 0 HG2 LYS A 115 -9.908 4.376 4.587 1.00 53.12 H new ATOM 0 HG3 LYS A 115 -9.859 3.228 5.910 1.00 53.12 H new ATOM 0 HD2 LYS A 115 -9.991 5.063 7.566 1.00 14.12 H new ATOM 0 HD3 LYS A 115 -9.901 6.262 6.292 1.00 14.12 H new ATOM 0 HE2 LYS A 115 -12.081 5.522 5.392 1.00 71.12 H new ATOM 0 HE3 LYS A 115 -12.164 4.237 6.581 1.00 71.12 H new ATOM 0 HZ1 LYS A 115 -13.464 6.151 7.266 1.00 5.41 H new ATOM 0 HZ2 LYS A 115 -12.176 5.909 8.346 1.00 5.41 H new ATOM 0 HZ3 LYS A 115 -12.095 7.154 7.193 1.00 5.41 H new ATOM 1946 N LEU A 116 -5.145 5.251 4.819 1.00 62.31 N ATOM 1947 CA LEU A 116 -3.692 5.265 5.028 1.00 72.02 C ATOM 1948 C LEU A 116 -3.125 6.701 4.908 1.00 20.02 C ATOM 1949 O LEU A 116 -2.464 7.169 5.828 1.00 41.14 O ATOM 1950 CB LEU A 116 -3.013 4.285 4.032 1.00 45.43 C ATOM 1951 CG LEU A 116 -3.285 2.760 4.280 1.00 73.55 C ATOM 1952 CD1 LEU A 116 -2.803 1.895 3.091 1.00 55.24 C ATOM 1953 CD2 LEU A 116 -2.630 2.295 5.600 1.00 75.05 C ATOM 0 H LEU A 116 -5.434 4.700 4.011 1.00 62.31 H new ATOM 0 HA LEU A 116 -3.473 4.927 6.041 1.00 72.02 H new ATOM 0 HB2 LEU A 116 -3.344 4.534 3.024 1.00 45.43 H new ATOM 0 HB3 LEU A 116 -1.936 4.452 4.064 1.00 45.43 H new ATOM 0 HG LEU A 116 -4.363 2.627 4.366 1.00 73.55 H new ATOM 0 HD11 LEU A 116 -3.008 0.845 3.299 1.00 55.24 H new ATOM 0 HD12 LEU A 116 -3.330 2.195 2.185 1.00 55.24 H new ATOM 0 HD13 LEU A 116 -1.731 2.035 2.950 1.00 55.24 H new ATOM 0 HD21 LEU A 116 -2.831 1.235 5.752 1.00 75.05 H new ATOM 0 HD22 LEU A 116 -1.553 2.456 5.548 1.00 75.05 H new ATOM 0 HD23 LEU A 116 -3.043 2.866 6.432 1.00 75.05 H new ATOM 1965 N LYS A 117 -3.421 7.390 3.781 1.00 10.21 N ATOM 1966 CA LYS A 117 -3.027 8.808 3.548 1.00 75.31 C ATOM 1967 C LYS A 117 -3.505 9.759 4.667 1.00 40.25 C ATOM 1968 O LYS A 117 -2.753 10.648 5.090 1.00 34.00 O ATOM 1969 CB LYS A 117 -3.511 9.301 2.151 1.00 34.04 C ATOM 1970 CG LYS A 117 -2.781 8.628 0.966 1.00 54.11 C ATOM 1971 CD LYS A 117 -3.257 9.090 -0.444 1.00 25.02 C ATOM 1972 CE LYS A 117 -2.906 10.556 -0.797 1.00 72.02 C ATOM 1973 NZ LYS A 117 -3.791 11.545 -0.116 1.00 42.11 N ATOM 0 H LYS A 117 -3.940 6.982 3.004 1.00 10.21 H new ATOM 0 HA LYS A 117 -1.937 8.832 3.567 1.00 75.31 H new ATOM 0 HB2 LYS A 117 -4.581 9.114 2.060 1.00 34.04 H new ATOM 0 HB3 LYS A 117 -3.370 10.380 2.088 1.00 34.04 H new ATOM 0 HG2 LYS A 117 -1.713 8.826 1.056 1.00 54.11 H new ATOM 0 HG3 LYS A 117 -2.913 7.549 1.043 1.00 54.11 H new ATOM 0 HD2 LYS A 117 -2.816 8.434 -1.194 1.00 25.02 H new ATOM 0 HD3 LYS A 117 -4.338 8.964 -0.507 1.00 25.02 H new ATOM 0 HE2 LYS A 117 -1.870 10.753 -0.521 1.00 72.02 H new ATOM 0 HE3 LYS A 117 -2.980 10.692 -1.876 1.00 72.02 H new ATOM 0 HZ1 LYS A 117 -4.304 12.101 -0.830 1.00 42.11 H new ATOM 0 HZ2 LYS A 117 -4.473 11.043 0.488 1.00 42.11 H new ATOM 0 HZ3 LYS A 117 -3.214 12.182 0.470 1.00 42.11 H new ATOM 1987 N GLU A 118 -4.732 9.548 5.160 1.00 42.31 N ATOM 1988 CA GLU A 118 -5.295 10.333 6.273 1.00 42.51 C ATOM 1989 C GLU A 118 -4.560 10.076 7.607 1.00 2.12 C ATOM 1990 O GLU A 118 -4.480 10.975 8.450 1.00 13.44 O ATOM 1991 CB GLU A 118 -6.814 10.049 6.419 1.00 11.30 C ATOM 1992 CG GLU A 118 -7.692 10.635 5.290 1.00 11.24 C ATOM 1993 CD GLU A 118 -7.688 12.179 5.256 1.00 52.12 C ATOM 1994 OE1 GLU A 118 -8.495 12.798 5.979 1.00 1.43 O ATOM 1995 OE2 GLU A 118 -6.868 12.783 4.525 1.00 41.44 O ATOM 0 H GLU A 118 -5.363 8.831 4.802 1.00 42.31 H new ATOM 0 HA GLU A 118 -5.151 11.386 6.031 1.00 42.51 H new ATOM 0 HB2 GLU A 118 -6.966 8.970 6.456 1.00 11.30 H new ATOM 0 HB3 GLU A 118 -7.155 10.452 7.372 1.00 11.30 H new ATOM 0 HG2 GLU A 118 -7.340 10.256 4.331 1.00 11.24 H new ATOM 0 HG3 GLU A 118 -8.716 10.283 5.415 1.00 11.24 H new ATOM 2002 N GLU A 119 -4.047 8.858 7.805 1.00 44.00 N ATOM 2003 CA GLU A 119 -3.279 8.514 9.016 1.00 64.22 C ATOM 2004 C GLU A 119 -1.843 9.053 8.945 1.00 64.13 C ATOM 2005 O GLU A 119 -1.312 9.578 9.937 1.00 72.34 O ATOM 2006 CB GLU A 119 -3.271 6.980 9.229 1.00 53.11 C ATOM 2007 CG GLU A 119 -4.635 6.364 9.585 1.00 1.12 C ATOM 2008 CD GLU A 119 -5.260 6.974 10.854 1.00 43.23 C ATOM 2009 OE1 GLU A 119 -4.829 6.621 11.972 1.00 64.30 O ATOM 2010 OE2 GLU A 119 -6.186 7.810 10.741 1.00 54.13 O ATOM 0 H GLU A 119 -4.148 8.089 7.143 1.00 44.00 H new ATOM 0 HA GLU A 119 -3.768 8.988 9.867 1.00 64.22 H new ATOM 0 HB2 GLU A 119 -2.901 6.505 8.321 1.00 53.11 H new ATOM 0 HB3 GLU A 119 -2.564 6.743 10.024 1.00 53.11 H new ATOM 0 HG2 GLU A 119 -5.319 6.502 8.748 1.00 1.12 H new ATOM 0 HG3 GLU A 119 -4.516 5.290 9.726 1.00 1.12 H new ATOM 2017 N ILE A 120 -1.226 8.946 7.760 1.00 72.12 N ATOM 2018 CA ILE A 120 0.202 9.253 7.579 1.00 45.32 C ATOM 2019 C ILE A 120 0.440 10.747 7.316 1.00 55.11 C ATOM 2020 O ILE A 120 1.584 11.193 7.320 1.00 4.15 O ATOM 2021 CB ILE A 120 0.846 8.390 6.427 1.00 53.03 C ATOM 2022 CG1 ILE A 120 0.294 8.801 5.019 1.00 73.14 C ATOM 2023 CG2 ILE A 120 0.620 6.883 6.695 1.00 40.31 C ATOM 2024 CD1 ILE A 120 0.899 8.062 3.829 1.00 23.13 C ATOM 0 H ILE A 120 -1.697 8.647 6.906 1.00 72.12 H new ATOM 0 HA ILE A 120 0.692 8.992 8.517 1.00 45.32 H new ATOM 0 HB ILE A 120 1.918 8.585 6.421 1.00 53.03 H new ATOM 0 HG12 ILE A 120 -0.784 8.642 5.012 1.00 73.14 H new ATOM 0 HG13 ILE A 120 0.460 9.870 4.882 1.00 73.14 H new ATOM 0 HG21 ILE A 120 1.070 6.299 5.892 1.00 40.31 H new ATOM 0 HG22 ILE A 120 1.080 6.609 7.644 1.00 40.31 H new ATOM 0 HG23 ILE A 120 -0.450 6.677 6.738 1.00 40.31 H new ATOM 0 HD11 ILE A 120 0.445 8.425 2.907 1.00 23.13 H new ATOM 0 HD12 ILE A 120 1.974 8.239 3.799 1.00 23.13 H new ATOM 0 HD13 ILE A 120 0.710 6.993 3.930 1.00 23.13 H new ATOM 2036 N LYS A 121 -0.642 11.527 7.111 1.00 10.43 N ATOM 2037 CA LYS A 121 -0.525 12.990 6.911 1.00 3.54 C ATOM 2038 C LYS A 121 -0.137 13.688 8.225 1.00 74.52 C ATOM 2039 O LYS A 121 0.430 14.780 8.217 1.00 52.40 O ATOM 2040 CB LYS A 121 -1.830 13.591 6.335 1.00 52.22 C ATOM 2041 CG LYS A 121 -3.037 13.587 7.299 1.00 21.34 C ATOM 2042 CD LYS A 121 -4.306 14.207 6.668 1.00 41.41 C ATOM 2043 CE LYS A 121 -5.500 14.227 7.638 1.00 71.40 C ATOM 2044 NZ LYS A 121 -6.695 14.865 7.020 1.00 71.34 N ATOM 0 H LYS A 121 -1.599 11.174 7.079 1.00 10.43 H new ATOM 0 HA LYS A 121 0.266 13.162 6.181 1.00 3.54 H new ATOM 0 HB2 LYS A 121 -1.634 14.618 6.028 1.00 52.22 H new ATOM 0 HB3 LYS A 121 -2.101 13.036 5.437 1.00 52.22 H new ATOM 0 HG2 LYS A 121 -3.251 12.562 7.603 1.00 21.34 H new ATOM 0 HG3 LYS A 121 -2.778 14.140 8.202 1.00 21.34 H new ATOM 0 HD2 LYS A 121 -4.087 15.225 6.346 1.00 41.41 H new ATOM 0 HD3 LYS A 121 -4.577 13.642 5.776 1.00 41.41 H new ATOM 0 HE2 LYS A 121 -5.744 13.208 7.937 1.00 71.40 H new ATOM 0 HE3 LYS A 121 -5.225 14.768 8.544 1.00 71.40 H new ATOM 0 HZ1 LYS A 121 -7.057 15.608 7.651 1.00 71.34 H new ATOM 0 HZ2 LYS A 121 -6.431 15.285 6.106 1.00 71.34 H new ATOM 0 HZ3 LYS A 121 -7.433 14.148 6.870 1.00 71.34 H new ATOM 2058 N ASN A 122 -0.441 13.022 9.348 1.00 41.20 N ATOM 2059 CA ASN A 122 -0.063 13.483 10.696 1.00 1.02 C ATOM 2060 C ASN A 122 1.416 13.154 10.993 1.00 20.23 C ATOM 2061 O ASN A 122 1.982 13.633 11.979 1.00 52.12 O ATOM 2062 CB ASN A 122 -0.994 12.826 11.751 1.00 61.23 C ATOM 2063 CG ASN A 122 -2.489 13.092 11.497 1.00 54.13 C ATOM 2064 OD1 ASN A 122 -2.872 14.123 10.942 1.00 34.32 O ATOM 2065 ND2 ASN A 122 -3.345 12.173 11.912 1.00 30.12 N ATOM 0 H ASN A 122 -0.959 12.143 9.349 1.00 41.20 H new ATOM 0 HA ASN A 122 -0.179 14.566 10.745 1.00 1.02 H new ATOM 0 HB2 ASN A 122 -0.820 11.750 11.758 1.00 61.23 H new ATOM 0 HB3 ASN A 122 -0.729 13.198 12.741 1.00 61.23 H new ATOM 0 HD21 ASN A 122 -4.346 12.310 11.775 1.00 30.12 H new ATOM 0 HD22 ASN A 122 -3.004 11.327 12.369 1.00 30.12 H new ATOM 2072 N ASN A 123 2.027 12.329 10.125 1.00 53.24 N ATOM 2073 CA ASN A 123 3.441 11.926 10.215 1.00 53.44 C ATOM 2074 C ASN A 123 4.273 12.811 9.282 1.00 12.32 C ATOM 2075 O ASN A 123 3.848 13.104 8.160 1.00 75.11 O ATOM 2076 CB ASN A 123 3.609 10.435 9.808 1.00 24.32 C ATOM 2077 CG ASN A 123 2.712 9.493 10.607 1.00 23.20 C ATOM 2078 OD1 ASN A 123 2.291 8.401 9.995 1.00 35.22 O flip ATOM 2079 ND2 ASN A 123 2.393 9.745 11.766 1.00 50.44 N flip ATOM 0 H ASN A 123 1.543 11.916 9.327 1.00 53.24 H new ATOM 0 HA ASN A 123 3.782 12.045 11.244 1.00 53.44 H new ATOM 0 HB2 ASN A 123 3.386 10.327 8.747 1.00 24.32 H new ATOM 0 HB3 ASN A 123 4.650 10.141 9.947 1.00 24.32 H new ATOM 0 HD21 ASN A 123 2.732 10.596 12.215 1.00 50.44 H new ATOM 0 HD22 ASN A 123 1.789 9.104 12.280 1.00 50.44 H new ATOM 2086 N ASN A 124 5.460 13.226 9.747 1.00 61.44 N ATOM 2087 CA ASN A 124 6.393 14.075 8.970 1.00 31.21 C ATOM 2088 C ASN A 124 7.483 13.213 8.303 1.00 3.43 C ATOM 2089 O ASN A 124 8.572 13.703 7.981 1.00 65.53 O ATOM 2090 CB ASN A 124 7.032 15.153 9.891 1.00 42.31 C ATOM 2091 CG ASN A 124 6.066 16.243 10.390 1.00 22.01 C ATOM 2092 OD1 ASN A 124 4.827 15.895 10.724 1.00 31.52 O flip ATOM 2093 ND2 ASN A 124 6.460 17.399 10.525 1.00 51.55 N flip ATOM 0 H ASN A 124 5.807 12.985 10.675 1.00 61.44 H new ATOM 0 HA ASN A 124 5.832 14.580 8.184 1.00 31.21 H new ATOM 0 HB2 ASN A 124 7.471 14.655 10.756 1.00 42.31 H new ATOM 0 HB3 ASN A 124 7.848 15.633 9.351 1.00 42.31 H new ATOM 0 HD21 ASN A 124 7.414 17.646 10.263 1.00 51.55 H new ATOM 0 HD22 ASN A 124 5.833 18.111 10.899 1.00 51.55 H new ATOM 2100 N ASN A 125 7.156 11.933 8.062 1.00 32.13 N ATOM 2101 CA ASN A 125 8.054 10.959 7.405 1.00 55.52 C ATOM 2102 C ASN A 125 7.758 10.906 5.893 1.00 64.21 C ATOM 2103 O ASN A 125 8.357 10.121 5.155 1.00 43.40 O ATOM 2104 CB ASN A 125 7.846 9.556 8.052 1.00 43.25 C ATOM 2105 CG ASN A 125 8.932 8.524 7.731 1.00 63.00 C ATOM 2106 OD1 ASN A 125 10.095 8.857 7.495 1.00 44.32 O ATOM 2107 ND2 ASN A 125 8.554 7.255 7.739 1.00 60.52 N ATOM 0 H ASN A 125 6.252 11.537 8.319 1.00 32.13 H new ATOM 0 HA ASN A 125 9.091 11.266 7.540 1.00 55.52 H new ATOM 0 HB2 ASN A 125 7.790 9.677 9.134 1.00 43.25 H new ATOM 0 HB3 ASN A 125 6.884 9.162 7.725 1.00 43.25 H new ATOM 0 HD21 ASN A 125 9.234 6.519 7.546 1.00 60.52 H new ATOM 0 HD22 ASN A 125 7.583 7.013 7.938 1.00 60.52 H new ATOM 2114 N ILE A 126 6.860 11.793 5.435 1.00 54.34 N ATOM 2115 CA ILE A 126 6.267 11.718 4.102 1.00 73.14 C ATOM 2116 C ILE A 126 7.199 12.335 3.061 1.00 62.24 C ATOM 2117 O ILE A 126 7.516 13.532 3.124 1.00 63.33 O ATOM 2118 CB ILE A 126 4.857 12.414 4.063 1.00 50.52 C ATOM 2119 CG1 ILE A 126 3.896 11.755 5.101 1.00 12.13 C ATOM 2120 CG2 ILE A 126 4.242 12.388 2.645 1.00 43.11 C ATOM 2121 CD1 ILE A 126 3.754 10.245 4.973 1.00 22.12 C ATOM 0 H ILE A 126 6.527 12.584 5.986 1.00 54.34 H new ATOM 0 HA ILE A 126 6.127 10.664 3.860 1.00 73.14 H new ATOM 0 HB ILE A 126 4.996 13.461 4.333 1.00 50.52 H new ATOM 0 HG12 ILE A 126 4.253 11.988 6.104 1.00 12.13 H new ATOM 0 HG13 ILE A 126 2.910 12.208 5.000 1.00 12.13 H new ATOM 0 HG21 ILE A 126 3.269 12.879 2.661 1.00 43.11 H new ATOM 0 HG22 ILE A 126 4.901 12.912 1.953 1.00 43.11 H new ATOM 0 HG23 ILE A 126 4.122 11.355 2.319 1.00 43.11 H new ATOM 0 HD11 ILE A 126 3.067 9.878 5.736 1.00 22.12 H new ATOM 0 HD12 ILE A 126 3.365 9.999 3.985 1.00 22.12 H new ATOM 0 HD13 ILE A 126 4.729 9.775 5.106 1.00 22.12 H new ATOM 2133 N MET A 127 7.635 11.498 2.112 1.00 11.24 N ATOM 2134 CA MET A 127 8.443 11.928 0.980 1.00 53.21 C ATOM 2135 C MET A 127 7.537 12.693 0.003 1.00 12.24 C ATOM 2136 O MET A 127 6.415 12.247 -0.293 1.00 72.34 O ATOM 2137 CB MET A 127 9.098 10.713 0.270 1.00 72.21 C ATOM 2138 CG MET A 127 9.925 9.784 1.174 1.00 4.10 C ATOM 2139 SD MET A 127 10.815 8.495 0.255 1.00 11.31 S ATOM 2140 CE MET A 127 9.509 7.749 -0.727 1.00 34.40 C ATOM 0 H MET A 127 7.432 10.498 2.114 1.00 11.24 H new ATOM 0 HA MET A 127 9.248 12.574 1.331 1.00 53.21 H new ATOM 0 HB2 MET A 127 8.312 10.125 -0.204 1.00 72.21 H new ATOM 0 HB3 MET A 127 9.743 11.084 -0.527 1.00 72.21 H new ATOM 0 HG2 MET A 127 10.643 10.381 1.737 1.00 4.10 H new ATOM 0 HG3 MET A 127 9.264 9.312 1.900 1.00 4.10 H new ATOM 0 HE1 MET A 127 9.897 6.868 -1.239 1.00 34.40 H new ATOM 0 HE2 MET A 127 8.686 7.457 -0.075 1.00 34.40 H new ATOM 0 HE3 MET A 127 9.151 8.469 -1.463 1.00 34.40 H new ATOM 2150 N ILE A 128 8.034 13.836 -0.480 1.00 41.23 N ATOM 2151 CA ILE A 128 7.316 14.710 -1.433 1.00 25.21 C ATOM 2152 C ILE A 128 7.178 14.019 -2.817 1.00 2.52 C ATOM 2153 O ILE A 128 6.366 14.417 -3.652 1.00 72.13 O ATOM 2154 CB ILE A 128 8.069 16.094 -1.576 1.00 34.41 C ATOM 2155 CG1 ILE A 128 8.331 16.722 -0.166 1.00 11.43 C ATOM 2156 CG2 ILE A 128 7.284 17.085 -2.478 1.00 64.30 C ATOM 2157 CD1 ILE A 128 9.132 18.011 -0.184 1.00 53.21 C ATOM 0 H ILE A 128 8.955 14.190 -0.222 1.00 41.23 H new ATOM 0 HA ILE A 128 6.314 14.895 -1.046 1.00 25.21 H new ATOM 0 HB ILE A 128 9.027 15.901 -2.059 1.00 34.41 H new ATOM 0 HG12 ILE A 128 7.372 16.913 0.315 1.00 11.43 H new ATOM 0 HG13 ILE A 128 8.857 15.992 0.450 1.00 11.43 H new ATOM 0 HG21 ILE A 128 7.833 18.024 -2.552 1.00 64.30 H new ATOM 0 HG22 ILE A 128 7.165 16.655 -3.473 1.00 64.30 H new ATOM 0 HG23 ILE A 128 6.302 17.273 -2.044 1.00 64.30 H new ATOM 0 HD11 ILE A 128 9.264 18.372 0.836 1.00 53.21 H new ATOM 0 HD12 ILE A 128 10.108 17.827 -0.632 1.00 53.21 H new ATOM 0 HD13 ILE A 128 8.600 18.762 -0.769 1.00 53.21 H new ATOM 2169 N LYS A 129 8.000 12.974 -3.034 1.00 32.31 N ATOM 2170 CA LYS A 129 8.022 12.150 -4.263 1.00 5.01 C ATOM 2171 C LYS A 129 7.963 10.659 -3.863 1.00 15.41 C ATOM 2172 O LYS A 129 8.095 10.317 -2.685 1.00 51.31 O ATOM 2173 CB LYS A 129 9.308 12.405 -5.132 1.00 51.12 C ATOM 2174 CG LYS A 129 9.370 13.725 -5.944 1.00 42.22 C ATOM 2175 CD LYS A 129 9.549 14.983 -5.071 1.00 42.54 C ATOM 2176 CE LYS A 129 9.990 16.207 -5.882 1.00 2.14 C ATOM 2177 NZ LYS A 129 9.033 16.539 -6.969 1.00 13.45 N ATOM 0 H LYS A 129 8.686 12.670 -2.343 1.00 32.31 H new ATOM 0 HA LYS A 129 7.159 12.428 -4.869 1.00 5.01 H new ATOM 0 HB2 LYS A 129 10.173 12.376 -4.470 1.00 51.12 H new ATOM 0 HB3 LYS A 129 9.413 11.575 -5.830 1.00 51.12 H new ATOM 0 HG2 LYS A 129 10.195 13.666 -6.654 1.00 42.22 H new ATOM 0 HG3 LYS A 129 8.455 13.826 -6.527 1.00 42.22 H new ATOM 0 HD2 LYS A 129 8.610 15.206 -4.565 1.00 42.54 H new ATOM 0 HD3 LYS A 129 10.288 14.780 -4.296 1.00 42.54 H new ATOM 0 HE2 LYS A 129 10.091 17.064 -5.216 1.00 2.14 H new ATOM 0 HE3 LYS A 129 10.974 16.020 -6.312 1.00 2.14 H new ATOM 0 HZ1 LYS A 129 9.356 17.393 -7.467 1.00 13.45 H new ATOM 0 HZ2 LYS A 129 8.980 15.746 -7.639 1.00 13.45 H new ATOM 0 HZ3 LYS A 129 8.092 16.711 -6.562 1.00 13.45 H new ATOM 2191 N TYR A 130 7.733 9.782 -4.854 1.00 4.11 N ATOM 2192 CA TYR A 130 7.791 8.315 -4.676 1.00 3.11 C ATOM 2193 C TYR A 130 8.072 7.618 -6.023 1.00 41.53 C ATOM 2194 O TYR A 130 8.180 8.278 -7.075 1.00 74.41 O ATOM 2195 CB TYR A 130 6.480 7.778 -4.033 1.00 53.41 C ATOM 2196 CG TYR A 130 5.228 7.849 -4.925 1.00 24.32 C ATOM 2197 CD1 TYR A 130 4.833 9.045 -5.531 1.00 44.41 C ATOM 2198 CD2 TYR A 130 4.437 6.718 -5.157 1.00 53.33 C ATOM 2199 CE1 TYR A 130 3.718 9.108 -6.332 1.00 30.31 C ATOM 2200 CE2 TYR A 130 3.317 6.788 -5.959 1.00 42.01 C ATOM 2201 CZ TYR A 130 2.967 7.988 -6.543 1.00 13.01 C ATOM 2202 OH TYR A 130 1.860 8.065 -7.352 1.00 54.24 O ATOM 0 H TYR A 130 7.501 10.068 -5.805 1.00 4.11 H new ATOM 0 HA TYR A 130 8.611 8.086 -3.996 1.00 3.11 H new ATOM 0 HB2 TYR A 130 6.638 6.740 -3.740 1.00 53.41 H new ATOM 0 HB3 TYR A 130 6.287 8.341 -3.120 1.00 53.41 H new ATOM 0 HD1 TYR A 130 5.416 9.939 -5.366 1.00 44.41 H new ATOM 0 HD2 TYR A 130 4.707 5.777 -4.702 1.00 53.33 H new ATOM 0 HE1 TYR A 130 3.436 10.043 -6.794 1.00 30.31 H new ATOM 0 HE2 TYR A 130 2.716 5.907 -6.129 1.00 42.01 H new ATOM 0 HH TYR A 130 1.050 7.999 -6.805 1.00 54.24 H new ATOM 2212 N HIS A 131 8.220 6.282 -5.964 1.00 24.34 N ATOM 2213 CA HIS A 131 8.423 5.423 -7.143 1.00 11.20 C ATOM 2214 C HIS A 131 7.152 4.562 -7.348 1.00 43.14 C ATOM 2215 O HIS A 131 6.961 3.575 -6.635 1.00 61.33 O ATOM 2216 CB HIS A 131 9.658 4.524 -6.940 1.00 22.30 C ATOM 2217 CG HIS A 131 10.926 5.265 -6.589 1.00 12.21 C ATOM 2218 ND1 HIS A 131 11.738 5.792 -7.554 1.00 53.54 N ATOM 2219 CD2 HIS A 131 11.462 5.536 -5.371 1.00 35.11 C ATOM 2220 CE1 HIS A 131 12.743 6.357 -6.920 1.00 61.13 C ATOM 2221 NE2 HIS A 131 12.619 6.231 -5.591 1.00 25.44 N ATOM 0 H HIS A 131 8.202 5.763 -5.086 1.00 24.34 H new ATOM 0 HA HIS A 131 8.596 6.037 -8.027 1.00 11.20 H new ATOM 0 HB2 HIS A 131 9.442 3.806 -6.149 1.00 22.30 H new ATOM 0 HB3 HIS A 131 9.828 3.952 -7.852 1.00 22.30 H new ATOM 0 HD2 HIS A 131 11.053 5.256 -4.412 1.00 35.11 H new ATOM 0 HE1 HIS A 131 13.565 6.859 -7.409 1.00 61.13 H new ATOM 0 HE2 HIS A 131 13.262 6.584 -4.882 1.00 25.44 H new ATOM 2229 N PRO A 132 6.257 4.922 -8.321 1.00 23.22 N ATOM 2230 CA PRO A 132 4.904 4.326 -8.457 1.00 32.12 C ATOM 2231 C PRO A 132 4.853 3.064 -9.342 1.00 73.34 C ATOM 2232 O PRO A 132 3.771 2.634 -9.744 1.00 0.21 O ATOM 2233 CB PRO A 132 4.144 5.483 -9.114 1.00 53.11 C ATOM 2234 CG PRO A 132 5.141 6.070 -10.056 1.00 43.12 C ATOM 2235 CD PRO A 132 6.495 5.926 -9.383 1.00 21.15 C ATOM 0 HA PRO A 132 4.505 3.973 -7.506 1.00 32.12 H new ATOM 0 HB2 PRO A 132 3.255 5.132 -9.639 1.00 53.11 H new ATOM 0 HB3 PRO A 132 3.811 6.213 -8.377 1.00 53.11 H new ATOM 0 HG2 PRO A 132 5.125 5.550 -11.014 1.00 43.12 H new ATOM 0 HG3 PRO A 132 4.916 7.117 -10.258 1.00 43.12 H new ATOM 0 HD2 PRO A 132 7.258 5.591 -10.086 1.00 21.15 H new ATOM 0 HD3 PRO A 132 6.838 6.874 -8.968 1.00 21.15 H new ATOM 2243 N LYS A 133 6.025 2.531 -9.708 1.00 73.24 N ATOM 2244 CA LYS A 133 6.144 1.281 -10.491 1.00 33.43 C ATOM 2245 C LYS A 133 6.502 0.116 -9.555 1.00 34.33 C ATOM 2246 O LYS A 133 6.763 0.329 -8.372 1.00 21.15 O ATOM 2247 CB LYS A 133 7.200 1.456 -11.634 1.00 11.44 C ATOM 2248 CG LYS A 133 6.671 2.119 -12.938 1.00 14.25 C ATOM 2249 CD LYS A 133 6.040 3.511 -12.713 1.00 31.03 C ATOM 2250 CE LYS A 133 5.642 4.211 -14.019 1.00 11.01 C ATOM 2251 NZ LYS A 133 4.582 3.482 -14.754 1.00 65.03 N ATOM 0 H LYS A 133 6.924 2.951 -9.472 1.00 73.24 H new ATOM 0 HA LYS A 133 5.189 1.052 -10.963 1.00 33.43 H new ATOM 0 HB2 LYS A 133 8.027 2.055 -11.252 1.00 11.44 H new ATOM 0 HB3 LYS A 133 7.605 0.475 -11.884 1.00 11.44 H new ATOM 0 HG2 LYS A 133 7.493 2.213 -13.647 1.00 14.25 H new ATOM 0 HG3 LYS A 133 5.930 1.463 -13.394 1.00 14.25 H new ATOM 0 HD2 LYS A 133 5.158 3.405 -12.081 1.00 31.03 H new ATOM 0 HD3 LYS A 133 6.746 4.140 -12.172 1.00 31.03 H new ATOM 0 HE2 LYS A 133 5.296 5.220 -13.796 1.00 11.01 H new ATOM 0 HE3 LYS A 133 6.520 4.309 -14.657 1.00 11.01 H new ATOM 0 HZ1 LYS A 133 4.218 4.080 -15.523 1.00 65.03 H new ATOM 0 HZ2 LYS A 133 4.976 2.606 -15.153 1.00 65.03 H new ATOM 0 HZ3 LYS A 133 3.806 3.247 -14.102 1.00 65.03 H new ATOM 2265 N PHE A 134 6.537 -1.105 -10.110 1.00 32.02 N ATOM 2266 CA PHE A 134 6.792 -2.333 -9.346 1.00 43.50 C ATOM 2267 C PHE A 134 8.303 -2.539 -9.157 1.00 31.10 C ATOM 2268 O PHE A 134 9.031 -2.769 -10.132 1.00 43.45 O ATOM 2269 CB PHE A 134 6.183 -3.564 -10.068 1.00 44.05 C ATOM 2270 CG PHE A 134 4.656 -3.640 -10.046 1.00 24.15 C ATOM 2271 CD1 PHE A 134 3.972 -3.777 -8.838 1.00 52.24 C ATOM 2272 CD2 PHE A 134 3.909 -3.619 -11.225 1.00 52.32 C ATOM 2273 CE1 PHE A 134 2.598 -3.886 -8.808 1.00 51.11 C ATOM 2274 CE2 PHE A 134 2.532 -3.724 -11.191 1.00 64.32 C ATOM 2275 CZ PHE A 134 1.878 -3.858 -9.987 1.00 44.05 C ATOM 0 H PHE A 134 6.388 -1.268 -11.106 1.00 32.02 H new ATOM 0 HA PHE A 134 6.320 -2.230 -8.369 1.00 43.50 H new ATOM 0 HB2 PHE A 134 6.516 -3.558 -11.106 1.00 44.05 H new ATOM 0 HB3 PHE A 134 6.583 -4.469 -9.610 1.00 44.05 H new ATOM 0 HD1 PHE A 134 4.527 -3.798 -7.912 1.00 52.24 H new ATOM 0 HD2 PHE A 134 4.413 -3.520 -12.175 1.00 52.32 H new ATOM 0 HE1 PHE A 134 2.085 -3.993 -7.864 1.00 51.11 H new ATOM 0 HE2 PHE A 134 1.967 -3.701 -12.111 1.00 64.32 H new ATOM 0 HZ PHE A 134 0.801 -3.941 -9.964 1.00 44.05 H new ATOM 2285 N TRP A 135 8.758 -2.439 -7.899 1.00 60.11 N ATOM 2286 CA TRP A 135 10.135 -2.745 -7.508 1.00 23.43 C ATOM 2287 C TRP A 135 10.390 -4.254 -7.600 1.00 41.40 C ATOM 2288 O TRP A 135 10.093 -5.015 -6.679 1.00 13.21 O ATOM 2289 CB TRP A 135 10.463 -2.178 -6.090 1.00 41.13 C ATOM 2290 CG TRP A 135 10.901 -0.727 -6.118 1.00 72.22 C ATOM 2291 CD1 TRP A 135 10.267 0.316 -6.734 1.00 64.01 C ATOM 2292 CD2 TRP A 135 12.081 -0.167 -5.514 1.00 52.35 C ATOM 2293 NE1 TRP A 135 10.988 1.467 -6.569 1.00 55.14 N ATOM 2294 CE2 TRP A 135 12.092 1.206 -5.815 1.00 30.53 C ATOM 2295 CE3 TRP A 135 13.125 -0.694 -4.747 1.00 63.53 C ATOM 2296 CZ2 TRP A 135 13.102 2.060 -5.381 1.00 51.42 C ATOM 2297 CZ3 TRP A 135 14.130 0.155 -4.316 1.00 53.22 C ATOM 2298 CH2 TRP A 135 14.110 1.520 -4.634 1.00 63.02 C ATOM 0 H TRP A 135 8.172 -2.140 -7.120 1.00 60.11 H new ATOM 0 HA TRP A 135 10.812 -2.251 -8.205 1.00 23.43 H new ATOM 0 HB2 TRP A 135 9.583 -2.274 -5.454 1.00 41.13 H new ATOM 0 HB3 TRP A 135 11.250 -2.781 -5.637 1.00 41.13 H new ATOM 0 HD1 TRP A 135 9.334 0.242 -7.272 1.00 64.01 H new ATOM 0 HE1 TRP A 135 10.738 2.379 -6.951 1.00 55.14 H new ATOM 0 HE3 TRP A 135 13.147 -1.744 -4.496 1.00 63.53 H new ATOM 0 HZ2 TRP A 135 13.089 3.112 -5.626 1.00 51.42 H new ATOM 0 HZ3 TRP A 135 14.943 -0.241 -3.725 1.00 53.22 H new ATOM 0 HH2 TRP A 135 14.907 2.157 -4.281 1.00 63.02 H new ATOM 2309 N THR A 136 10.852 -4.656 -8.777 1.00 41.11 N ATOM 2310 CA THR A 136 11.381 -5.984 -9.057 1.00 52.01 C ATOM 2311 C THR A 136 12.841 -5.768 -9.495 1.00 33.54 C ATOM 2312 O THR A 136 13.098 -5.005 -10.432 1.00 3.24 O ATOM 2313 CB THR A 136 10.515 -6.723 -10.150 1.00 45.14 C ATOM 2314 OG1 THR A 136 11.181 -7.901 -10.613 1.00 4.34 O ATOM 2315 CG2 THR A 136 10.145 -5.830 -11.346 1.00 51.04 C ATOM 0 H THR A 136 10.869 -4.044 -9.592 1.00 41.11 H new ATOM 0 HA THR A 136 11.340 -6.634 -8.183 1.00 52.01 H new ATOM 0 HB THR A 136 9.582 -6.995 -9.657 1.00 45.14 H new ATOM 0 HG1 THR A 136 10.627 -8.346 -11.288 1.00 4.34 H new ATOM 0 HG21 THR A 136 9.550 -6.403 -12.057 1.00 51.04 H new ATOM 0 HG22 THR A 136 9.568 -4.974 -10.996 1.00 51.04 H new ATOM 0 HG23 THR A 136 11.055 -5.479 -11.833 1.00 51.04 H new ATOM 2323 N ASP A 137 13.806 -6.372 -8.775 1.00 42.21 N ATOM 2324 CA ASP A 137 15.233 -6.015 -8.914 1.00 3.51 C ATOM 2325 C ASP A 137 15.800 -6.492 -10.259 1.00 61.32 C ATOM 2326 O ASP A 137 15.444 -7.577 -10.724 1.00 43.13 O ATOM 2327 CB ASP A 137 16.066 -6.591 -7.734 1.00 0.40 C ATOM 2328 CG ASP A 137 17.364 -5.790 -7.489 1.00 52.11 C ATOM 2329 OD1 ASP A 137 18.314 -5.890 -8.297 1.00 72.23 O ATOM 2330 OD2 ASP A 137 17.431 -5.036 -6.497 1.00 54.03 O ATOM 0 H ASP A 137 13.625 -7.108 -8.092 1.00 42.21 H new ATOM 0 HA ASP A 137 15.305 -4.928 -8.887 1.00 3.51 H new ATOM 0 HB2 ASP A 137 15.461 -6.585 -6.827 1.00 0.40 H new ATOM 0 HB3 ASP A 137 16.317 -7.631 -7.943 1.00 0.40 H new ATOM 2335 N GLY A 138 16.687 -5.662 -10.855 1.00 43.44 N ATOM 2336 CA GLY A 138 17.286 -5.934 -12.160 1.00 62.35 C ATOM 2337 C GLY A 138 16.284 -5.834 -13.303 1.00 14.42 C ATOM 2338 O GLY A 138 16.333 -6.618 -14.260 1.00 51.14 O ATOM 0 H GLY A 138 17.001 -4.787 -10.435 1.00 43.44 H new ATOM 0 HA2 GLY A 138 18.100 -5.231 -12.334 1.00 62.35 H new ATOM 0 HA3 GLY A 138 17.723 -6.932 -12.153 1.00 62.35 H new ATOM 2342 N SER A 139 15.370 -4.856 -13.198 1.00 34.21 N ATOM 2343 CA SER A 139 14.264 -4.661 -14.160 1.00 43.01 C ATOM 2344 C SER A 139 14.113 -3.161 -14.482 1.00 54.32 C ATOM 2345 O SER A 139 14.948 -2.344 -14.068 1.00 43.03 O ATOM 2346 CB SER A 139 12.965 -5.239 -13.549 1.00 14.24 C ATOM 2347 OG SER A 139 13.143 -6.587 -13.135 1.00 74.41 O ATOM 0 H SER A 139 15.374 -4.173 -12.441 1.00 34.21 H new ATOM 0 HA SER A 139 14.475 -5.183 -15.093 1.00 43.01 H new ATOM 0 HB2 SER A 139 12.660 -4.632 -12.696 1.00 14.24 H new ATOM 0 HB3 SER A 139 12.160 -5.185 -14.282 1.00 14.24 H new ATOM 0 HG SER A 139 13.215 -6.622 -12.158 1.00 74.41 H new ATOM 2353 N TYR A 140 13.054 -2.800 -15.228 1.00 45.01 N ATOM 2354 CA TYR A 140 12.787 -1.411 -15.622 1.00 2.13 C ATOM 2355 C TYR A 140 11.619 -0.854 -14.806 1.00 24.40 C ATOM 2356 O TYR A 140 10.464 -1.158 -15.084 1.00 4.41 O ATOM 2357 CB TYR A 140 12.505 -1.329 -17.149 1.00 62.34 C ATOM 2358 CG TYR A 140 13.629 -1.960 -17.989 1.00 72.35 C ATOM 2359 CD1 TYR A 140 14.850 -1.310 -18.165 1.00 24.52 C ATOM 2360 CD2 TYR A 140 13.481 -3.229 -18.564 1.00 3.02 C ATOM 2361 CE1 TYR A 140 15.879 -1.896 -18.882 1.00 71.55 C ATOM 2362 CE2 TYR A 140 14.504 -3.811 -19.285 1.00 3.20 C ATOM 2363 CZ TYR A 140 15.697 -3.146 -19.440 1.00 55.33 C ATOM 2364 OH TYR A 140 16.718 -3.742 -20.152 1.00 62.24 O ATOM 0 H TYR A 140 12.361 -3.465 -15.573 1.00 45.01 H new ATOM 0 HA TYR A 140 13.666 -0.801 -15.414 1.00 2.13 H new ATOM 0 HB2 TYR A 140 11.564 -1.833 -17.369 1.00 62.34 H new ATOM 0 HB3 TYR A 140 12.382 -0.285 -17.437 1.00 62.34 H new ATOM 0 HD1 TYR A 140 14.996 -0.331 -17.734 1.00 24.52 H new ATOM 0 HD2 TYR A 140 12.550 -3.762 -18.441 1.00 3.02 H new ATOM 0 HE1 TYR A 140 16.819 -1.378 -19.004 1.00 71.55 H new ATOM 0 HE2 TYR A 140 14.367 -4.787 -19.727 1.00 3.20 H new ATOM 0 HH TYR A 140 16.423 -4.619 -20.475 1.00 62.24 H new ATOM 2374 N GLN A 141 11.952 -0.086 -13.757 1.00 52.23 N ATOM 2375 CA GLN A 141 10.982 0.681 -12.955 1.00 23.51 C ATOM 2376 C GLN A 141 10.746 2.063 -13.607 1.00 71.42 C ATOM 2377 O GLN A 141 11.081 2.262 -14.774 1.00 75.02 O ATOM 2378 CB GLN A 141 11.497 0.835 -11.482 1.00 51.45 C ATOM 2379 CG GLN A 141 11.371 -0.428 -10.589 1.00 22.53 C ATOM 2380 CD GLN A 141 12.451 -1.510 -10.792 1.00 72.04 C ATOM 2381 OE1 GLN A 141 13.037 -1.669 -11.854 1.00 34.25 O ATOM 2382 NE2 GLN A 141 12.703 -2.286 -9.762 1.00 52.02 N ATOM 0 H GLN A 141 12.914 0.022 -13.437 1.00 52.23 H new ATOM 0 HA GLN A 141 10.034 0.145 -12.925 1.00 23.51 H new ATOM 0 HB2 GLN A 141 12.545 1.133 -11.512 1.00 51.45 H new ATOM 0 HB3 GLN A 141 10.948 1.649 -11.008 1.00 51.45 H new ATOM 0 HG2 GLN A 141 11.391 -0.114 -9.545 1.00 22.53 H new ATOM 0 HG3 GLN A 141 10.395 -0.879 -10.768 1.00 22.53 H new ATOM 0 HE21 GLN A 141 12.207 -2.143 -8.882 1.00 52.02 H new ATOM 0 HE22 GLN A 141 13.394 -3.032 -9.842 1.00 52.02 H new ATOM 2391 N CYS A 142 10.161 2.991 -12.830 1.00 10.54 N ATOM 2392 CA CYS A 142 9.949 4.397 -13.215 1.00 12.13 C ATOM 2393 C CYS A 142 11.280 5.064 -13.634 1.00 64.12 C ATOM 2394 O CYS A 142 11.466 5.412 -14.805 1.00 30.22 O ATOM 2395 CB CYS A 142 9.299 5.120 -12.012 1.00 35.15 C ATOM 2396 SG CYS A 142 9.926 4.534 -10.406 1.00 23.32 S ATOM 0 H CYS A 142 9.814 2.779 -11.894 1.00 10.54 H new ATOM 0 HA CYS A 142 9.290 4.460 -14.081 1.00 12.13 H new ATOM 0 HB2 CYS A 142 9.481 6.191 -12.098 1.00 35.15 H new ATOM 0 HB3 CYS A 142 8.219 4.976 -12.049 1.00 35.15 H new ATOM 0 HG CYS A 142 10.305 5.551 -9.691 1.00 23.32 H new ATOM 2401 N CYS A 143 12.211 5.197 -12.674 1.00 32.55 N ATOM 2402 CA CYS A 143 13.584 5.689 -12.931 1.00 5.33 C ATOM 2403 C CYS A 143 14.579 4.521 -13.049 1.00 43.11 C ATOM 2404 O CYS A 143 15.791 4.749 -13.129 1.00 24.53 O ATOM 2405 CB CYS A 143 13.990 6.641 -11.795 1.00 34.44 C ATOM 2406 SG CYS A 143 13.876 5.890 -10.145 1.00 60.44 S ATOM 0 H CYS A 143 12.037 4.967 -11.696 1.00 32.55 H new ATOM 0 HA CYS A 143 13.603 6.225 -13.880 1.00 5.33 H new ATOM 0 HB2 CYS A 143 15.013 6.978 -11.962 1.00 34.44 H new ATOM 0 HB3 CYS A 143 13.354 7.525 -11.828 1.00 34.44 H new ATOM 0 HG CYS A 143 12.736 6.202 -9.604 1.00 60.44 H new ATOM 2411 N ARG A 144 14.038 3.276 -13.049 1.00 43.43 N ATOM 2412 CA ARG A 144 14.806 2.008 -13.164 1.00 44.21 C ATOM 2413 C ARG A 144 15.627 1.715 -11.886 1.00 40.44 C ATOM 2414 O ARG A 144 16.429 0.769 -11.866 1.00 0.11 O ATOM 2415 CB ARG A 144 15.719 1.957 -14.446 1.00 72.45 C ATOM 2416 CG ARG A 144 14.993 1.692 -15.793 1.00 4.00 C ATOM 2417 CD ARG A 144 14.026 2.807 -16.229 1.00 1.32 C ATOM 2418 NE ARG A 144 13.364 2.490 -17.507 1.00 30.12 N ATOM 2419 CZ ARG A 144 12.160 2.955 -17.895 1.00 3.24 C ATOM 2420 NH1 ARG A 144 11.462 3.770 -17.116 1.00 34.40 N ATOM 2421 NH2 ARG A 144 11.670 2.600 -19.074 1.00 22.20 N ATOM 0 H ARG A 144 13.033 3.122 -12.967 1.00 43.43 H new ATOM 0 HA ARG A 144 14.063 1.219 -13.276 1.00 44.21 H new ATOM 0 HB2 ARG A 144 16.253 2.904 -14.525 1.00 72.45 H new ATOM 0 HB3 ARG A 144 16.469 1.179 -14.302 1.00 72.45 H new ATOM 0 HG2 ARG A 144 15.742 1.553 -16.573 1.00 4.00 H new ATOM 0 HG3 ARG A 144 14.437 0.758 -15.714 1.00 4.00 H new ATOM 0 HD2 ARG A 144 13.272 2.956 -15.456 1.00 1.32 H new ATOM 0 HD3 ARG A 144 14.573 3.745 -16.326 1.00 1.32 H new ATOM 0 HE ARG A 144 13.856 1.869 -18.149 1.00 30.12 H new ATOM 0 HH11 ARG A 144 11.835 4.053 -16.210 1.00 34.40 H new ATOM 0 HH12 ARG A 144 10.552 4.114 -17.423 1.00 34.40 H new ATOM 0 HH21 ARG A 144 12.203 1.978 -19.682 1.00 22.20 H new ATOM 0 HH22 ARG A 144 10.759 2.948 -19.374 1.00 22.20 H new ATOM 2435 N GLN A 145 15.405 2.506 -10.817 1.00 30.32 N ATOM 2436 CA GLN A 145 16.125 2.346 -9.544 1.00 54.45 C ATOM 2437 C GLN A 145 15.494 1.235 -8.697 1.00 10.22 C ATOM 2438 O GLN A 145 14.267 1.161 -8.553 1.00 51.21 O ATOM 2439 CB GLN A 145 16.161 3.676 -8.756 1.00 0.05 C ATOM 2440 CG GLN A 145 16.993 4.782 -9.437 1.00 53.13 C ATOM 2441 CD GLN A 145 17.122 6.080 -8.629 1.00 24.22 C ATOM 2442 OE1 GLN A 145 16.081 6.461 -7.891 1.00 33.33 O flip ATOM 2443 NE2 GLN A 145 18.140 6.763 -8.712 1.00 24.04 N flip ATOM 0 H GLN A 145 14.726 3.267 -10.814 1.00 30.32 H new ATOM 0 HA GLN A 145 17.151 2.061 -9.774 1.00 54.45 H new ATOM 0 HB2 GLN A 145 15.141 4.034 -8.620 1.00 0.05 H new ATOM 0 HB3 GLN A 145 16.568 3.488 -7.763 1.00 0.05 H new ATOM 0 HG2 GLN A 145 17.992 4.394 -9.637 1.00 53.13 H new ATOM 0 HG3 GLN A 145 16.542 5.014 -10.402 1.00 53.13 H new ATOM 0 HE21 GLN A 145 18.922 6.446 -9.285 1.00 24.04 H new ATOM 0 HE22 GLN A 145 18.203 7.647 -8.208 1.00 24.04 H new ATOM 2452 N THR A 146 16.368 0.373 -8.151 1.00 65.14 N ATOM 2453 CA THR A 146 15.996 -0.751 -7.291 1.00 32.24 C ATOM 2454 C THR A 146 17.209 -1.157 -6.429 1.00 4.30 C ATOM 2455 O THR A 146 17.936 -2.107 -6.725 1.00 4.04 O ATOM 2456 CB THR A 146 15.408 -1.948 -8.120 1.00 63.14 C ATOM 2457 OG1 THR A 146 15.168 -3.081 -7.277 1.00 2.35 O ATOM 2458 CG2 THR A 146 16.292 -2.350 -9.319 1.00 52.44 C ATOM 0 H THR A 146 17.374 0.444 -8.302 1.00 65.14 H new ATOM 0 HA THR A 146 15.194 -0.441 -6.621 1.00 32.24 H new ATOM 0 HB THR A 146 14.462 -1.597 -8.532 1.00 63.14 H new ATOM 0 HG1 THR A 146 16.013 -3.548 -7.109 1.00 2.35 H new ATOM 0 HG21 THR A 146 15.829 -3.182 -9.849 1.00 52.44 H new ATOM 0 HG22 THR A 146 16.396 -1.501 -9.995 1.00 52.44 H new ATOM 0 HG23 THR A 146 17.276 -2.651 -8.961 1.00 52.44 H new ATOM 2466 N GLU A 147 17.449 -0.367 -5.374 1.00 34.50 N ATOM 2467 CA GLU A 147 18.592 -0.542 -4.450 1.00 21.24 C ATOM 2468 C GLU A 147 18.133 -0.352 -3.007 1.00 14.52 C ATOM 2469 O GLU A 147 18.208 -1.268 -2.181 1.00 53.50 O ATOM 2470 CB GLU A 147 19.744 0.458 -4.810 1.00 70.41 C ATOM 2471 CG GLU A 147 20.626 0.032 -6.000 1.00 31.52 C ATOM 2472 CD GLU A 147 21.419 -1.258 -5.717 1.00 3.13 C ATOM 2473 OE1 GLU A 147 22.540 -1.174 -5.166 1.00 73.14 O ATOM 2474 OE2 GLU A 147 20.916 -2.361 -6.020 1.00 34.41 O ATOM 0 H GLU A 147 16.851 0.423 -5.130 1.00 34.50 H new ATOM 0 HA GLU A 147 18.981 -1.555 -4.555 1.00 21.24 H new ATOM 0 HB2 GLU A 147 19.305 1.431 -5.032 1.00 70.41 H new ATOM 0 HB3 GLU A 147 20.379 0.588 -3.934 1.00 70.41 H new ATOM 0 HG2 GLU A 147 19.998 -0.117 -6.878 1.00 31.52 H new ATOM 0 HG3 GLU A 147 21.321 0.837 -6.239 1.00 31.52 H new ATOM 2481 N LYS A 148 17.626 0.844 -2.742 1.00 13.13 N ATOM 2482 CA LYS A 148 17.246 1.307 -1.406 1.00 51.30 C ATOM 2483 C LYS A 148 16.267 2.472 -1.598 1.00 13.34 C ATOM 2484 O LYS A 148 16.215 3.050 -2.699 1.00 45.43 O ATOM 2485 CB LYS A 148 18.543 1.715 -0.622 1.00 32.35 C ATOM 2486 CG LYS A 148 18.357 2.228 0.843 1.00 41.22 C ATOM 2487 CD LYS A 148 18.252 3.773 0.963 1.00 30.41 C ATOM 2488 CE LYS A 148 19.506 4.493 0.428 1.00 11.10 C ATOM 2489 NZ LYS A 148 19.403 5.973 0.542 1.00 65.32 N ATOM 0 H LYS A 148 17.461 1.542 -3.468 1.00 13.13 H new ATOM 0 HA LYS A 148 16.754 0.534 -0.815 1.00 51.30 H new ATOM 0 HB2 LYS A 148 19.208 0.852 -0.596 1.00 32.35 H new ATOM 0 HB3 LYS A 148 19.052 2.493 -1.191 1.00 32.35 H new ATOM 0 HG2 LYS A 148 17.457 1.779 1.263 1.00 41.22 H new ATOM 0 HG3 LYS A 148 19.196 1.883 1.447 1.00 41.22 H new ATOM 0 HD2 LYS A 148 17.376 4.118 0.413 1.00 30.41 H new ATOM 0 HD3 LYS A 148 18.100 4.044 2.008 1.00 30.41 H new ATOM 0 HE2 LYS A 148 20.382 4.149 0.979 1.00 11.10 H new ATOM 0 HE3 LYS A 148 19.659 4.222 -0.616 1.00 11.10 H new ATOM 0 HZ1 LYS A 148 20.270 6.411 0.170 1.00 65.32 H new ATOM 0 HZ2 LYS A 148 18.584 6.307 -0.005 1.00 65.32 H new ATOM 0 HZ3 LYS A 148 19.284 6.237 1.541 1.00 65.32 H new ATOM 2503 N LEU A 149 15.490 2.793 -0.546 1.00 35.44 N ATOM 2504 CA LEU A 149 14.515 3.901 -0.540 1.00 74.35 C ATOM 2505 C LEU A 149 15.153 5.216 -1.038 1.00 52.33 C ATOM 2506 O LEU A 149 15.867 5.904 -0.298 1.00 71.31 O ATOM 2507 CB LEU A 149 13.947 4.095 0.891 1.00 43.03 C ATOM 2508 CG LEU A 149 13.275 2.849 1.546 1.00 33.30 C ATOM 2509 CD1 LEU A 149 12.908 3.136 3.015 1.00 60.20 C ATOM 2510 CD2 LEU A 149 12.040 2.386 0.736 1.00 11.25 C ATOM 0 H LEU A 149 15.522 2.283 0.337 1.00 35.44 H new ATOM 0 HA LEU A 149 13.705 3.642 -1.222 1.00 74.35 H new ATOM 0 HB2 LEU A 149 14.759 4.425 1.539 1.00 43.03 H new ATOM 0 HB3 LEU A 149 13.215 4.902 0.861 1.00 43.03 H new ATOM 0 HG LEU A 149 13.996 2.032 1.534 1.00 33.30 H new ATOM 0 HD11 LEU A 149 12.441 2.254 3.452 1.00 60.20 H new ATOM 0 HD12 LEU A 149 13.811 3.383 3.574 1.00 60.20 H new ATOM 0 HD13 LEU A 149 12.213 3.974 3.059 1.00 60.20 H new ATOM 0 HD21 LEU A 149 11.594 1.516 1.218 1.00 11.25 H new ATOM 0 HD22 LEU A 149 11.308 3.193 0.695 1.00 11.25 H new ATOM 0 HD23 LEU A 149 12.347 2.122 -0.276 1.00 11.25 H new ATOM 2522 N ALA A 150 14.964 5.491 -2.327 1.00 14.33 N ATOM 2523 CA ALA A 150 15.355 6.758 -2.947 1.00 55.45 C ATOM 2524 C ALA A 150 14.184 7.749 -2.784 1.00 4.20 C ATOM 2525 O ALA A 150 13.029 7.302 -2.756 1.00 41.04 O ATOM 2526 CB ALA A 150 15.730 6.520 -4.423 1.00 33.33 C ATOM 0 H ALA A 150 14.531 4.835 -2.978 1.00 14.33 H new ATOM 0 HA ALA A 150 16.236 7.183 -2.465 1.00 55.45 H new ATOM 0 HB1 ALA A 150 16.021 7.465 -4.882 1.00 33.33 H new ATOM 0 HB2 ALA A 150 16.563 5.819 -4.478 1.00 33.33 H new ATOM 0 HB3 ALA A 150 14.872 6.107 -4.954 1.00 33.33 H new ATOM 2532 N PRO A 151 14.449 9.099 -2.671 1.00 70.05 N ATOM 2533 CA PRO A 151 13.393 10.124 -2.406 1.00 62.44 C ATOM 2534 C PRO A 151 12.180 10.022 -3.359 1.00 53.41 C ATOM 2535 O PRO A 151 11.048 10.294 -2.954 1.00 60.31 O ATOM 2536 CB PRO A 151 14.145 11.475 -2.582 1.00 52.20 C ATOM 2537 CG PRO A 151 15.445 11.126 -3.256 1.00 51.33 C ATOM 2538 CD PRO A 151 15.786 9.741 -2.774 1.00 34.52 C ATOM 0 HA PRO A 151 12.952 9.997 -1.417 1.00 62.44 H new ATOM 0 HB2 PRO A 151 13.564 12.172 -3.186 1.00 52.20 H new ATOM 0 HB3 PRO A 151 14.319 11.956 -1.619 1.00 52.20 H new ATOM 0 HG2 PRO A 151 15.344 11.151 -4.341 1.00 51.33 H new ATOM 0 HG3 PRO A 151 16.228 11.837 -2.992 1.00 51.33 H new ATOM 0 HD2 PRO A 151 16.436 9.216 -3.474 1.00 34.52 H new ATOM 0 HD3 PRO A 151 16.302 9.761 -1.814 1.00 34.52 H new ATOM 2546 N GLY A 152 12.444 9.625 -4.617 1.00 62.21 N ATOM 2547 CA GLY A 152 11.400 9.418 -5.621 1.00 71.01 C ATOM 2548 C GLY A 152 11.657 10.216 -6.880 1.00 2.20 C ATOM 2549 O GLY A 152 12.430 11.177 -6.863 1.00 32.54 O ATOM 0 H GLY A 152 13.387 9.441 -4.960 1.00 62.21 H new ATOM 0 HA2 GLY A 152 11.341 8.358 -5.869 1.00 71.01 H new ATOM 0 HA3 GLY A 152 10.434 9.702 -5.203 1.00 71.01 H new ATOM 2553 N CYS A 153 11.013 9.807 -7.974 1.00 53.43 N ATOM 2554 CA CYS A 153 11.082 10.493 -9.276 1.00 70.31 C ATOM 2555 C CYS A 153 9.757 11.213 -9.578 1.00 21.43 C ATOM 2556 O CYS A 153 9.749 12.319 -10.127 1.00 10.10 O ATOM 2557 CB CYS A 153 11.397 9.443 -10.355 1.00 70.33 C ATOM 2558 SG CYS A 153 10.315 7.985 -10.259 1.00 75.33 S ATOM 0 H CYS A 153 10.419 8.978 -7.986 1.00 53.43 H new ATOM 0 HA CYS A 153 11.866 11.250 -9.260 1.00 70.31 H new ATOM 0 HB2 CYS A 153 11.297 9.900 -11.340 1.00 70.33 H new ATOM 0 HB3 CYS A 153 12.435 9.126 -10.255 1.00 70.33 H new ATOM 0 HG CYS A 153 10.473 7.402 -9.108 1.00 75.33 H new ATOM 2563 N GLU A 154 8.645 10.579 -9.178 1.00 43.34 N ATOM 2564 CA GLU A 154 7.281 11.057 -9.466 1.00 74.01 C ATOM 2565 C GLU A 154 6.736 11.846 -8.275 1.00 53.33 C ATOM 2566 O GLU A 154 6.977 11.464 -7.137 1.00 72.12 O ATOM 2567 CB GLU A 154 6.374 9.843 -9.757 1.00 11.03 C ATOM 2568 CG GLU A 154 6.692 9.122 -11.076 1.00 11.11 C ATOM 2569 CD GLU A 154 6.106 9.819 -12.313 1.00 0.41 C ATOM 2570 OE1 GLU A 154 4.897 9.639 -12.585 1.00 51.14 O ATOM 2571 OE2 GLU A 154 6.846 10.530 -13.028 1.00 13.54 O ATOM 0 H GLU A 154 8.665 9.712 -8.641 1.00 43.34 H new ATOM 0 HA GLU A 154 7.302 11.715 -10.335 1.00 74.01 H new ATOM 0 HB2 GLU A 154 6.464 9.132 -8.936 1.00 11.03 H new ATOM 0 HB3 GLU A 154 5.336 10.176 -9.779 1.00 11.03 H new ATOM 0 HG2 GLU A 154 7.774 9.048 -11.189 1.00 11.11 H new ATOM 0 HG3 GLU A 154 6.307 8.104 -11.026 1.00 11.11 H new ATOM 2578 N LYS A 155 5.976 12.916 -8.563 1.00 52.14 N ATOM 2579 CA LYS A 155 5.362 13.779 -7.539 1.00 64.25 C ATOM 2580 C LYS A 155 4.349 12.984 -6.678 1.00 12.45 C ATOM 2581 O LYS A 155 3.561 12.188 -7.205 1.00 2.22 O ATOM 2582 CB LYS A 155 4.701 15.032 -8.230 1.00 22.14 C ATOM 2583 CG LYS A 155 3.710 14.748 -9.406 1.00 64.33 C ATOM 2584 CD LYS A 155 2.269 14.401 -8.945 1.00 70.12 C ATOM 2585 CE LYS A 155 1.419 13.757 -10.052 1.00 35.12 C ATOM 2586 NZ LYS A 155 0.179 13.132 -9.508 1.00 41.31 N ATOM 0 H LYS A 155 5.769 13.208 -9.518 1.00 52.14 H new ATOM 0 HA LYS A 155 6.135 14.137 -6.859 1.00 64.25 H new ATOM 0 HB2 LYS A 155 4.169 15.599 -7.467 1.00 22.14 H new ATOM 0 HB3 LYS A 155 5.499 15.673 -8.605 1.00 22.14 H new ATOM 0 HG2 LYS A 155 3.672 15.623 -10.055 1.00 64.33 H new ATOM 0 HG3 LYS A 155 4.098 13.923 -10.004 1.00 64.33 H new ATOM 0 HD2 LYS A 155 2.320 13.722 -8.094 1.00 70.12 H new ATOM 0 HD3 LYS A 155 1.776 15.310 -8.599 1.00 70.12 H new ATOM 0 HE2 LYS A 155 1.151 14.513 -10.790 1.00 35.12 H new ATOM 0 HE3 LYS A 155 2.009 13.001 -10.570 1.00 35.12 H new ATOM 0 HZ1 LYS A 155 -0.625 13.360 -10.127 1.00 41.31 H new ATOM 0 HZ2 LYS A 155 0.301 12.100 -9.465 1.00 41.31 H new ATOM 0 HZ3 LYS A 155 -0.004 13.499 -8.552 1.00 41.31 H new ATOM 2600 N TYR A 156 4.431 13.137 -5.350 1.00 50.23 N ATOM 2601 CA TYR A 156 3.423 12.597 -4.422 1.00 52.20 C ATOM 2602 C TYR A 156 2.564 13.742 -3.867 1.00 63.43 C ATOM 2603 O TYR A 156 3.054 14.586 -3.100 1.00 75.02 O ATOM 2604 CB TYR A 156 4.101 11.812 -3.268 1.00 52.35 C ATOM 2605 CG TYR A 156 3.108 11.234 -2.241 1.00 2.22 C ATOM 2606 CD1 TYR A 156 2.069 10.389 -2.641 1.00 22.20 C ATOM 2607 CD2 TYR A 156 3.197 11.544 -0.879 1.00 4.41 C ATOM 2608 CE1 TYR A 156 1.165 9.879 -1.725 1.00 5.31 C ATOM 2609 CE2 TYR A 156 2.291 11.030 0.033 1.00 52.31 C ATOM 2610 CZ TYR A 156 1.284 10.203 -0.390 1.00 22.04 C ATOM 2611 OH TYR A 156 0.381 9.700 0.525 1.00 32.42 O ATOM 0 H TYR A 156 5.192 13.635 -4.889 1.00 50.23 H new ATOM 0 HA TYR A 156 2.781 11.904 -4.965 1.00 52.20 H new ATOM 0 HB2 TYR A 156 4.687 10.996 -3.691 1.00 52.35 H new ATOM 0 HB3 TYR A 156 4.799 12.472 -2.753 1.00 52.35 H new ATOM 0 HD1 TYR A 156 1.970 10.129 -3.685 1.00 22.20 H new ATOM 0 HD2 TYR A 156 3.986 12.195 -0.534 1.00 4.41 H new ATOM 0 HE1 TYR A 156 0.368 9.229 -2.055 1.00 5.31 H new ATOM 0 HE2 TYR A 156 2.378 11.281 1.080 1.00 52.31 H new ATOM 0 HH TYR A 156 0.104 8.801 0.251 1.00 32.42 H new ATOM 2621 N ASN A 157 1.282 13.789 -4.271 1.00 61.21 N ATOM 2622 CA ASN A 157 0.316 14.773 -3.759 1.00 32.03 C ATOM 2623 C ASN A 157 -0.503 14.139 -2.613 1.00 14.44 C ATOM 2624 O ASN A 157 -1.492 13.430 -2.833 1.00 25.23 O ATOM 2625 CB ASN A 157 -0.584 15.350 -4.900 1.00 23.00 C ATOM 2626 CG ASN A 157 -1.205 14.291 -5.828 1.00 0.43 C ATOM 2627 OD1 ASN A 157 -0.614 13.919 -6.845 1.00 3.32 O ATOM 2628 ND2 ASN A 157 -2.393 13.810 -5.492 1.00 14.41 N ATOM 0 H ASN A 157 0.889 13.147 -4.960 1.00 61.21 H new ATOM 0 HA ASN A 157 0.857 15.629 -3.354 1.00 32.03 H new ATOM 0 HB2 ASN A 157 -1.387 15.935 -4.450 1.00 23.00 H new ATOM 0 HB3 ASN A 157 0.012 16.036 -5.502 1.00 23.00 H new ATOM 0 HD21 ASN A 157 -2.845 13.111 -6.081 1.00 14.41 H new ATOM 0 HD22 ASN A 157 -2.855 14.139 -4.644 1.00 14.41 H new ATOM 2635 N LEU A 158 -0.023 14.363 -1.378 1.00 1.42 N ATOM 2636 CA LEU A 158 -0.691 13.906 -0.145 1.00 54.42 C ATOM 2637 C LEU A 158 -2.000 14.693 0.069 1.00 71.43 C ATOM 2638 O LEU A 158 -3.025 14.136 0.479 1.00 72.33 O ATOM 2639 CB LEU A 158 0.272 14.087 1.058 1.00 12.12 C ATOM 2640 CG LEU A 158 -0.256 13.639 2.460 1.00 22.13 C ATOM 2641 CD1 LEU A 158 -0.649 12.143 2.479 1.00 2.31 C ATOM 2642 CD2 LEU A 158 0.782 13.962 3.557 1.00 14.34 C ATOM 0 H LEU A 158 0.845 14.870 -1.205 1.00 1.42 H new ATOM 0 HA LEU A 158 -0.945 12.850 -0.233 1.00 54.42 H new ATOM 0 HB2 LEU A 158 1.187 13.533 0.847 1.00 12.12 H new ATOM 0 HB3 LEU A 158 0.545 15.141 1.119 1.00 12.12 H new ATOM 0 HG LEU A 158 -1.164 14.205 2.669 1.00 22.13 H new ATOM 0 HD11 LEU A 158 -1.010 11.874 3.472 1.00 2.31 H new ATOM 0 HD12 LEU A 158 -1.436 11.964 1.746 1.00 2.31 H new ATOM 0 HD13 LEU A 158 0.222 11.535 2.233 1.00 2.31 H new ATOM 0 HD21 LEU A 158 0.398 13.644 4.526 1.00 14.34 H new ATOM 0 HD22 LEU A 158 1.712 13.435 3.344 1.00 14.34 H new ATOM 0 HD23 LEU A 158 0.969 15.036 3.576 1.00 14.34 H new ATOM 2654 N PHE A 159 -1.942 15.999 -0.226 1.00 75.42 N ATOM 2655 CA PHE A 159 -3.098 16.903 -0.158 1.00 22.51 C ATOM 2656 C PHE A 159 -3.499 17.323 -1.576 1.00 30.22 C ATOM 2657 O PHE A 159 -2.782 18.066 -2.254 1.00 61.41 O ATOM 2658 CB PHE A 159 -2.784 18.132 0.730 1.00 62.32 C ATOM 2659 CG PHE A 159 -2.487 17.749 2.181 1.00 24.34 C ATOM 2660 CD1 PHE A 159 -3.523 17.482 3.075 1.00 4.04 C ATOM 2661 CD2 PHE A 159 -1.177 17.615 2.639 1.00 31.45 C ATOM 2662 CE1 PHE A 159 -3.259 17.104 4.377 1.00 61.41 C ATOM 2663 CE2 PHE A 159 -0.916 17.230 3.940 1.00 13.12 C ATOM 2664 CZ PHE A 159 -1.957 16.977 4.807 1.00 71.11 C ATOM 0 H PHE A 159 -1.082 16.462 -0.521 1.00 75.42 H new ATOM 0 HA PHE A 159 -3.938 16.381 0.301 1.00 22.51 H new ATOM 0 HB2 PHE A 159 -1.928 18.665 0.316 1.00 62.32 H new ATOM 0 HB3 PHE A 159 -3.630 18.819 0.705 1.00 62.32 H new ATOM 0 HD1 PHE A 159 -4.547 17.572 2.745 1.00 4.04 H new ATOM 0 HD2 PHE A 159 -0.355 17.815 1.968 1.00 31.45 H new ATOM 0 HE1 PHE A 159 -4.074 16.908 5.058 1.00 61.41 H new ATOM 0 HE2 PHE A 159 0.105 17.127 4.278 1.00 13.12 H new ATOM 0 HZ PHE A 159 -1.751 16.679 5.824 1.00 71.11 H new